| MCULE-4254870575 |
1 |
C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(O)C=1)O)O |
|
| MCULE-2327386216 |
1 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-2394173874 |
1 |
C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O |
|
| MCULE-2692728789 |
1 |
C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O |
|
| MCULE-4871721304 |
1 |
C12C(O)=CC(=CC=1O[C@H]([C@H](O)C2=O)C1C=CC(=C(O)C=1)O)O |
|
| MCULE-2567986775 |
1 |
O1C2=CC(=CC(=C2C([C@H]([C@@H]1C1=CC=C(C(=C1)O)O)O)=O)O)O |
|
| MCULE-2296975795 |
1 |
C12=C(O)C=C(C=C1O[C@@H]([C@@H](O)C2=O)C1=CC(O)=C(C(O)=C1)O)O |
|
| MCULE-6698156528 |
1 |
O1C2=CC(=CC(=C2C([C@@H]([C@@H]1C1=CC(=C(C(=C1)O)O)O)O)=O)O)O |
|
| MCULE-2809167723 |
1 |
C12=C(O)C=C(C=C1OC(C(O)C2=O)C1=CC(O)=C(C(O)=C1)O)O |
|
| MolPort-002-043-207 |
1 |
CC(C)(N)C(O)c1ccccc1 |
|
| MCULE-9634821184 |
0.99 |
O1C2C=C(O)C=CC=2C([C@H](O)[C@H]1C1=CC(O)=C(C(O)=C1)O)=O |
|
| MCULE-5340165807 |
0.99 |
C1(O)C=C2OC(C(C(=O)C2=CC=1)O)C1C=C(O)C(O)=C(O)C=1 |
|
| MCULE-3231582881 |
0.99 |
[C@H]1([C@@H](O)C(C2C=CC(O)=CC=2O1)=O)C1C=CC(O)=C(O)C=1 |
|
| MCULE-5665116242 |
0.99 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1 |
|
| MCULE-1856015315 |
0.98 |
O(C)C1C=CC([C@H]2OC3=CC(O)=CC(O)=C3C([C@@H]2O)=O)=CC=1O |
|
| MCULE-1480766301 |
0.98 |
C1(OC)=CC(O)=C2C([C@@H]([C@@H](C3C=CC(O)=C(O)C=3)OC2=C1)O)=O |
|
| MCULE-6991857034 |
0.97 |
OC1C=CC([C@@H]2OC3=CC(O)=C(C)C(O)=C3C([C@H]2O)=O)=CC=1O |
|
| MCULE-2605725094 |
0.97 |
C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1 |
|
| MCULE-4812868362 |
0.97 |
OC1C(O)=CC([C@@H]2OC3C(C([C@H]2O)=O)=C(O)C(C)=C(O)C=3)=CC=1O |
|
| MCULE-8224104004 |
0.97 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-4817576208 |
0.97 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C |
|
| MCULE-1338747805 |
0.97 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C |
|
| MolPort-046-508-858 |
0.97 |
Cl.C[C@@H](N)[C@@](C)(O)c1ccccc1 |
|
| MolPort-042-605-543 |
0.97 |
Cl.CC(N)C(C)(O)c1ccccc1 |
|
| MolPort-046-508-858 |
0.97 |
Cl.C[C@@H](N)[C@@](C)(O)c1ccccc1 |
|
| MolPort-042-605-543 |
0.97 |
Cl.CC(N)C(C)(O)c1ccccc1 |
|
| MolPort-006-013-400 |
0.95 |
CC(N)C(O)c1ccc(C)cc1 |
|
| MCULE-6429597192 |
0.93 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-3029164834 |
0.93 |
C1(O)C=C2O[C@H]([C@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1 |
|
| MCULE-3493265138 |
0.93 |
C12C(OC)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(OC)C=1)OC)OC |
|
| MCULE-9182612724 |
0.92 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=CC=1 |
|
| MCULE-5559057559 |
0.92 |
C1(O)C=C2O[C@H]([C@@H](C(C2=CC=1)=O)O)C1C=CC(O)=CC=1 |
|
| MCULE-4463093454 |
0.92 |
C12C(O)=CC(O)=CC=1O[C@H](C1C=CC=CC=1)[C@@H](O)C2=O |
|
| MCULE-4560358638 |
0.92 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MolPort-038-947-951 |
0.92 |
Cl.CC(N)C(O)c1ccc(C)cc1 |
|
| MolPort-003-910-763 |
0.92 |
N[C@@H](CO)[C@@H](O)c1ccccc1 |
|
| MolPort-038-947-951 |
0.92 |
Cl.CC(N)C(O)c1ccc(C)cc1 |
|
| MolPort-001-846-012 |
0.92 |
N[C@H](CO)[C@H](O)c1ccccc1 |
|
| MCULE-3159000697 |
0.91 |
C1(OC)C=C2O[C@@H]([C@@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1 |
|
| MCULE-1545228810 |
0.90 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1 |
|
| MCULE-5733387532 |
0.90 |
C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C |
|
| MolPort-003-925-592 |
0.90 |
C[C@H](N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-001-795-087 |
0.90 |
C[C@@H](N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-008-545-738 |
0.90 |
CCC(N)C(O)c1ccccc1 |
|
| MolPort-008-546-115 |
0.90 |
CC(C)C(N)C(O)c1ccccc1 |
|
| MCULE-8678602121 |
0.89 |
C1(O)=CC(O)=C2C(CC(C3C=CC(O)=C(O)C=3)OC2=C1)=O |
|
| MCULE-1688833251 |
0.89 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-3225229511 |
0.89 |
C1(O)C(O)=CC([C@H]2OC3C=C(O)C=C(O)C=3C(=O)C2)=CC=1 |
|
| MCULE-1604093945 |
0.89 |
C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-3965785693 |
0.88 |
C1(C2=CC=C(OCC3=CC=CC=C3)C(OCC3=CC=CC=C3)=C2)OC2=C(C=CC=C2)C(=O)C1O |
|
| MCULE-1131774635 |
0.88 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1 |
|
| MCULE-9899038190 |
0.88 |
OC1C=C2OC(C3C=CC(O)=C(O)C=3)CC(C2=CC=1)=O |
|
| MCULE-6906830879 |
0.88 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)CC(=O)C2=CC=1 |
|
| MCULE-3714829206 |
0.88 |
C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-6286398411 |
0.88 |
C1(O)C=C2O[C@H](C3C=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MolPort-016-636-000 |
0.88 |
Cl.CCC(N)C(O)c1ccccc1 |
|
| MolPort-004-814-013 |
0.88 |
NC1(CC1)C(O)c1ccccc1 |
|
| MCULE-2703837005 |
0.87 |
C1(OC)C=C2OC(CC(C2=C(O)C=1)=O)C1C=CC(O)=C(O)C=1 |
|
| MCULE-2028448851 |
0.87 |
C1(O)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1 |
|
| MCULE-9044534531 |
0.87 |
C12C(O)=CC(O)=CC=1OC(CC2=O)C1C=CC(OC)=C(O)C=1 |
|
| MCULE-4502863447 |
0.87 |
O([C@@H]1[C@@H](C2C=CC(O)=C(O)C=2)OC2C(C1=O)=C(O)C=C(OC)C=2)C(C)=O |
|
| MCULE-2236290715 |
0.87 |
C12=C(O)C=C(O)C=C1O[C@H](CC2=O)C1=CC=C(OC)C(O)=C1 |
|
| MCULE-9396529091 |
0.87 |
C1(O)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1 |
|
| MCULE-7131810532 |
0.87 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)O |
|
| MCULE-3924606015 |
0.87 |
C1(O)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-4928479927 |
0.87 |
C1(OC)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-9587381415 |
0.86 |
C1(O)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-5463631459 |
0.86 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-3324355674 |
0.86 |
C1(C=C2OC(CC(C2=C(O)C=1)=O)C1=CC=C(O)C(OC)=C1)O |
|
| MCULE-8635359097 |
0.86 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1O |
|
| MolPort-000-001-182 |
0.86 |
CC(O)(CN)c1ccccc1 |
|
| MolPort-000-001-183 |
0.86 |
NC[C@@H](O)c1ccccc1 |
|
| MolPort-001-770-902 |
0.86 |
NCC(O)c1ccccc1 |
|
| MolPort-000-001-184 |
0.86 |
NC[C@H](O)c1ccccc1 |
|
| MCULE-6390383057 |
0.85 |
COC1C=C(C2C(CO)OC3C=C(C4C(O)C(=O)C5C(=CC(=CC=5O)O)O4)C=CC=3O2)C=CC=1O |
|
| MCULE-4152291525 |
0.85 |
C12C(O)=CC(=CC=1O[C@@]([C@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1C=CC(=C(OC)C=1)O)O |
|
| MCULE-9575020223 |
0.85 |
C1(O)C(O)=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1 |
|
| MCULE-6463439345 |
0.85 |
C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O |
|
| MCULE-9092075985 |
0.85 |
C1(O)C=C2O[C@H](C3C=CC4O[C@H](C5C=CC(OC)=C(O)C=5)[C@@H](CO)OC=4C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-7830277688 |
0.85 |
C1(OC)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-8379030042 |
0.85 |
C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O |
|
| MCULE-7201821938 |
0.85 |
C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC2=C(C=1)OC(C(CO)O2)C1=CC=C(C(OC)=C1)O)O |
|
| MCULE-6637888420 |
0.85 |
O1C2C=C(C=CC=2O[C@@H](CO)[C@@H]1C1=CC=C(C(=C1)OC)O)[C@H]1[C@H](C(C2=C(C=C(C=C2O1)O)O)=O)O |
|
| MCULE-9566565950 |
0.85 |
O=C1C2C(=CC(=CC=2O[C@H](C2C=C3C(O[C@H]([C@H](O3)C3C=C(OC)C(O)=CC=3)CO)=CC=2)[C@H]1O)O)O |
|
| MolPort-046-763-401 |
0.85 |
Cl.CN[C@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-046-763-401 |
0.85 |
Cl.CN[C@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-029-672-717 |
0.85 |
CCC(CN)(OC)c1ccccc1 |
|
| MolPort-029-672-717 |
0.85 |
CCC(CN)(OC)c1ccccc1 |
|
| MCULE-9385881266 |
0.84 |
C1(O)C=C2O[C@H](C3C=C(O)C4O[C@@H](C5C=C(OC)C(O)=CC=5)[C@H](CO)C=4C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-6930739422 |
0.84 |
C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1=CC=C(C=C1)O)OC/C=C(\C)/C |
|
| MCULE-2295691776 |
0.84 |
[C@@H]1([C@H](O)C(C2C=CC=CC=2O1)=O)C1C=CC=CC=1 |
|
| MCULE-6480805780 |
0.84 |
C1(=O)C2=CC=CC=C2OC(C2C=CC=CC=2)C1O |
|
| MCULE-6923632463 |
0.84 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1O |
|
| MolPort-001-794-232 |
0.84 |
N[C@H](CO)Cc1ccccc1 |
|
| MolPort-001-769-020 |
0.84 |
N[C@@H](CO)Cc1ccccc1 |
|
| MolPort-012-782-657 |
0.84 |
CC(C(N)CO)c1ccccc1 |
|
| MolPort-004-961-843 |
0.84 |
NC(CO)Cc1ccccc1 |
|
| MCULE-9660563348 |
0.83 |
C12C=CC(OC)=CC=1OC(CC2=O)C1C=CC(OC)=C(OC)C=1 |
|
| MCULE-5242974703 |
0.83 |
C1(OC)C(CC(O)C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-8022818849 |
0.83 |
C1(=CC(=C2C(O[C@@H](C3=CC=C(C(O)=C3)O)[C@H](O)C2)=C1)O)OC(=O)C1=CC(O)=C(O)C(O)=C1 |
|
| MCULE-9971134031 |
0.83 |
C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1 |
|
| MCULE-4219942050 |
0.83 |
O1C(C(O)CC2C(=CC(O)=CC1=2)O)C1C=CC(O)=C(O)C=1 |
|
| MCULE-8436122228 |
0.83 |
[C@@H]1([C@H](O)CC2C(O)=CC(O)=CC=2O1)C1=CC(=C(O)C(O)=C1)O |
|
| MCULE-3245144995 |
0.83 |
OC1=CC(O)=C2C(O[C@@H]([C@H](O)C2)C2C=C(O)C(O)=C(O)C=2)=C1 |
|
| MCULE-8775451204 |
0.83 |
C1C(O)=C2C[C@@H](O)[C@H](OC2=CC=1O)C1C=C(C(=CC=1)O)O |
|
| MCULE-5749472487 |
0.83 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1 |
|
| MCULE-9354240076 |
0.83 |
OC1=CC(=C2C(=C1)O[C@@H]([C@H](C2)O)C1=CC=C(C(=C1)O)O)O |
|
| MCULE-4522193885 |
0.83 |
C1(O)C=C2O[C@@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1 |
|
| MCULE-9338438267 |
0.83 |
C1(O)C=C2O[C@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1 |
|
| MCULE-1532117250 |
0.83 |
C1C(O)=C2C[C@@H]([C@H](OC2=CC=1O)C1C=C(O)C(O)=CC=1)O |
|
| MCULE-8978551782 |
0.83 |
COC1=CC(C2OC3C=C(OC)C=CC=3C(=O)C2)=CC(OC)=C1OC |
|
| MCULE-1292125513 |
0.83 |
O1[C@@H]([C@H](O)CC2C(=CC(O)=CC1=2)O)C1=CC=C(C(O)=C1)O |
|
| MolPort-008-752-133 |
0.83 |
NCC(O)(C1CC1)c1ccccc1 |
|
| MolPort-004-289-082 |
0.83 |
NCC(O)c1cccc2ccccc12 |
|
| MolPort-035-783-594 |
0.83 |
Cl.NC[C@@H](O)c1ccccc1 |
|
| MolPort-035-789-350 |
0.83 |
Cl.NC(Cc1ccccc1)C(O)c1ccccc1 |
|
| MolPort-006-709-532 |
0.83 |
Cl.NC[C@H](O)c1ccccc1 |
|
| MolPort-001-769-623 |
0.83 |
NCC(O)c1ccc2ccccc2c1 |
|
| MolPort-035-783-594 |
0.83 |
Cl.NC[C@@H](O)c1ccccc1 |
|
| MolPort-035-789-350 |
0.83 |
Cl.NC(Cc1ccccc1)C(O)c1ccccc1 |
|
| MCULE-7104867839 |
0.82 |
C1(C)C(O)=C2C(CC(OC2=CC=1O)C1C=CC(O)=CC=1)=O |
|
| MCULE-2527326110 |
0.82 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-3254872691 |
0.82 |
C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O |
|
| MCULE-6964743359 |
0.82 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=CC=1)OC)O |
|
| MCULE-4005429744 |
0.82 |
C1C(=O)C2=C(O)C=C(O)C=C2O[C@@H]1C1C=CC(O)=CC=1 |
|
| MCULE-6826487644 |
0.82 |
C1(=O)C2C=CC=CC=2OC(C2C=CC(=CC=2)O)C1OC |
|
| MCULE-5489217450 |
0.82 |
C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)O |
|
| MCULE-9439004515 |
0.82 |
C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)OC)O |
|
| MCULE-4193299594 |
0.82 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1OC |
|
| MCULE-5852778653 |
0.82 |
C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O |
|
| MCULE-8195585327 |
0.82 |
C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-7997155475 |
0.82 |
C1(O)C=C2O[C@H](C3C=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MolPort-029-907-848 |
0.82 |
Cl.Cc1ccc(CC(N)CO)cc1 |
|
| MolPort-020-122-976 |
0.82 |
Cl.CC(C(N)CO)c1ccccc1 |
|
| MolPort-020-122-976 |
0.82 |
Cl.CC(C(N)CO)c1ccccc1 |
|
| MolPort-029-907-848 |
0.82 |
Cl.Cc1ccc(CC(N)CO)cc1 |
|
| MCULE-9302131889 |
0.81 |
C1(O)C=C2OC(C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-9370973230 |
0.81 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-5771493344 |
0.81 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1 |
|
| MCULE-6698275589 |
0.81 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-2337043419 |
0.81 |
C12C=C(C=CC=1C(CC(C1=CC=CC=C1)O2)=O)O |
|
| MCULE-4107309014 |
0.81 |
C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C |
|
| MCULE-8726416131 |
0.81 |
C1(O)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=CC=1 |
|
| MCULE-3601358321 |
0.81 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC |
|
| MCULE-9660679251 |
0.81 |
C1(O)C=C2OC(CC(C2=C(O)C=1OC)=O)C1C=CC=CC=1 |
|
| MCULE-5001672302 |
0.81 |
C1(C)C(O)=C2C(CC(OC2=C(C)C=1O)C1C=CC(O)=CC=1)=O |
|
| MCULE-8000658254 |
0.81 |
C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(OC)C=3)CC(=O)C2=C(O)C=1OC |
|
| MCULE-9865914914 |
0.81 |
C1(O)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC(O)=CC=1 |
|
| MCULE-2064774552 |
0.81 |
OC1C=CC(C2OC3=CC(O)=CC=C3C(=O)C2)=CC=1 |
|
| MCULE-3335674808 |
0.81 |
OC1C=CC([C@@H]2OC3C(C(=O)[C@H]2O)=C(O)C=C(O)C=3C/C=C(\C)/C)=CC=1 |
|
| MCULE-1890542536 |
0.81 |
C1(O)C2C(CC(C3C=C(O)C(OC)=CC=3)OC=2C=C(OC)C=1OC)=O |
|
| MCULE-6580599773 |
0.81 |
C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C |
|
| MCULE-6753110271 |
0.81 |
C12=C(C)C(O)=CC(O)=C1C(C[C@@H](C1C=CC=CC=1)O2)=O |
|
| MCULE-6631561492 |
0.81 |
C1C(=O)C2C(=CC(O)=CC=2O)O[C@@H]1C1C=CC=CC=1 |
|
| MCULE-1297538743 |
0.81 |
C1(OC)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1 |
|
| MCULE-3324744620 |
0.81 |
[C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@]1(O)C |
|
| MCULE-5306878717 |
0.81 |
C12=CC(O)=CC=C1C(=O)C[C@@]([H])(C1C=CC(=CC=1)O)O2 |
|
| MCULE-3240859900 |
0.81 |
C1(OC)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1 |
|
| MCULE-5637234780 |
0.81 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1 |
|
| MCULE-1539908631 |
0.81 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-2862082028 |
0.81 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-001-793-079 |
0.81 |
CC(C)[C@H](N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-003-733-063 |
0.81 |
CC(N)Cc1cccc(C)c1 |
|
| MolPort-003-748-955 |
0.81 |
Cc1ccc(cc1)C(O)CN |
|
| MolPort-003-748-956 |
0.81 |
CCc1ccc(cc1)C(O)CN |
|
| MolPort-002-344-064 |
0.81 |
CC(C)[C@@H](N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-000-145-724 |
0.81 |
CC(C)C(N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-022-373-873 |
0.81 |
CCCC(N)C(O)c1ccccc1 |
|
| MolPort-020-142-699 |
0.81 |
NCC(O)(Cc1ccccc1)c1ccccc1 |
|
| MolPort-003-748-968 |
0.81 |
CC(C)(C)c1ccc(cc1)C(O)CN |
|
| MolPort-022-373-873 |
0.81 |
CCCC(N)C(O)c1ccccc1 |
|
| MolPort-020-142-699 |
0.81 |
NCC(O)(Cc1ccccc1)c1ccccc1 |
|
| MCULE-3703285153 |
0.80 |
C1(O)C=C2O[C@H](C3C(O)=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-8139621595 |
0.80 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1 |
|
| MCULE-2855478624 |
0.80 |
C1(O)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-4287681592 |
0.80 |
C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)[C@@H](O)[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O |
|
| MCULE-7826903505 |
0.80 |
C1(O)C=C2OC(C3C=CC=CC=3)CC(C2=C(OC)C=1)=O |
|
| MCULE-1040954793 |
0.80 |
O1C2C=CC=CC=2C(CC1C1C=CC=C(O)C=1)=O |
|
| MCULE-4496634668 |
0.80 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(OC4C=CC([C@@H]5CC(=O)C6C(O)=CC(O)=CC=6O5)=CC=4)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-8498690406 |
0.80 |
COC1=CC(OC)=CC2=C1C(=O)CC(C1=CC=C(OC)C=C1)O2 |
|
| MCULE-8068976578 |
0.80 |
C12C(OC)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)OC |
|
| MCULE-4204496934 |
0.80 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)CC2=C(OC)C=1 |
|
| MCULE-7196504979 |
0.80 |
C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-7258052902 |
0.80 |
C1(OC)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-4547911471 |
0.80 |
C1(OC)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C |
|
| MCULE-1272280425 |
0.80 |
C12C(=O)CC(OC=1C=C(OC)C(C)=C2O)C1C=CC=CC=1 |
|
| MCULE-6305563775 |
0.80 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-5052743999 |
0.80 |
O=C1C2C(=CC(=CC=2OC(C2C=CC=CC=2)C1)OC)O |
|
| MCULE-1231893585 |
0.80 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-8084114235 |
0.80 |
[C@H]1(C2=CC=CC=C2)OC2=CC(O)=CC(OC)=C2C(=O)C1 |
|
| MolPort-039-242-201 |
0.80 |
CCN(CC)[C@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-003-928-694 |
0.80 |
CC[C@@H](O)c1ccccc1 |
|
| MolPort-006-013-403 |
0.80 |
CC(N)C(O)c1ccc(Br)cc1 |
|
| MolPort-006-393-679 |
0.80 |
CCN(CC)[C@@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-001-790-106 |
0.80 |
NC(C(O)c1ccccc1)c1ccccc1 |
|
| MolPort-006-118-956 |
0.80 |
CCN(C)C(C)C(O)c1ccccc1 |
|
| MolPort-001-784-305 |
0.80 |
CC(C)(C)C(O)c1ccccc1 |
|
| MolPort-001-794-198 |
0.80 |
N[C@H]([C@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-001-794-197 |
0.80 |
N[C@@H]([C@@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-011-893-265 |
0.80 |
CC(C)C(C)(O)c1ccccc1 |
|
| MolPort-020-904-109 |
0.80 |
CCNC(C)C(O)c1ccccc1 |
|
| MolPort-001-784-304 |
0.80 |
CC(C)C(O)c1ccccc1 |
|
| MolPort-001-790-614 |
0.80 |
CCC(C)(O)c1ccccc1 |
|
| MolPort-001-793-409 |
0.80 |
CC[C@H](O)c1ccccc1 |
|
| MolPort-020-904-109 |
0.80 |
CCNC(C)C(O)c1ccccc1 |
|
| MolPort-039-242-201 |
0.80 |
CCN(CC)[C@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-001-759-790 |
0.80 |
CCC(O)c1ccccc1 |
|
| MCULE-3316368164 |
0.79 |
C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCO2)=C1 |
|
| MCULE-7797086388 |
0.79 |
O1C2C=CC=CC=2C(CC1C1C=CC(=C(OC)C=1)OC)=O |
|
| MCULE-4427780251 |
0.79 |
C12=C(C)C(OC)=CC(O)=C1C(CC(C1C=CC=CC=1)O2)=O |
|
| MCULE-9332914030 |
0.79 |
C12C=C(OC)C=CC=1C(CC(C1C=CC=CC=1)O2)=O |
|
| MCULE-9298140592 |
0.79 |
O1C2C=CC=CC=2C(C[C@]1([H])C1=CC=C2C(OCCO2)=C1)=O |
|
| MCULE-2232530891 |
0.79 |
C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC |
|
| MCULE-2108662486 |
0.79 |
C12OC3C(C)(C)C3C1=C1OC(C3C=CC=CC=3)CC(C1=C(OC)C=2)=O |
|
| MCULE-7233709477 |
0.79 |
C12C(=O)CC(OC=1C(=C(O)C(C)=C2O)C=O)C1=CC=CC=C1 |
|
| MCULE-7442958115 |
0.79 |
OC1C=CC(C2OC3C(C(=O)C2)=C(O)C=C(O)C=3)=C(O)C=1 |
|
| MCULE-9197350217 |
0.79 |
C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MCULE-7259979801 |
0.79 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MCULE-8604836333 |
0.79 |
C12OC(C)(C)CCC1=C1O[C@H](C3C=CC=CC=3)CC(=O)C1=C(O)C=2 |
|
| MCULE-7275500281 |
0.79 |
C1(OC)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC=CC=1 |
|
| MolPort-020-063-078 |
0.79 |
Cl.CC(N)Cc1cc(C)cc(C)c1 |
|
| MolPort-020-393-670 |
0.79 |
Cl.Cc1ccc(cc1)C(O)CN |
|
| MolPort-033-355-983 |
0.79 |
Cl.Cc1ccc(cc1)[C@H](O)CN |
|
| MolPort-033-355-909 |
0.79 |
Cl.Cc1ccc(cc1)[C@@H](O)CN |
|
| MolPort-029-944-048 |
0.79 |
NCC[C@@H](O)c1ccccc1 |
|
| MolPort-020-722-645 |
0.79 |
CC(O)(CCN)c1ccccc1 |
|
| MolPort-029-944-049 |
0.79 |
NCC[C@H](O)c1ccccc1 |
|
| MolPort-000-000-571 |
0.79 |
NCCC(O)c1ccccc1 |
|
| MolPort-029-944-048 |
0.79 |
NCC[C@@H](O)c1ccccc1 |
|
| MolPort-029-944-049 |
0.79 |
NCC[C@H](O)c1ccccc1 |
|
| MolPort-020-063-078 |
0.79 |
Cl.CC(N)Cc1cc(C)cc(C)c1 |
|
| MolPort-012-471-830 |
0.79 |
Cc1cc(C)cc(c1)C(O)CN |
|
| MolPort-020-393-670 |
0.79 |
Cl.Cc1ccc(cc1)C(O)CN |
|
| MolPort-033-355-983 |
0.79 |
Cl.Cc1ccc(cc1)[C@H](O)CN |
|
| MolPort-033-355-909 |
0.79 |
Cl.Cc1ccc(cc1)[C@@H](O)CN |
|
| MolPort-003-748-954 |
0.79 |
Cc1cccc(c1)C(O)CN |
|
| MolPort-020-722-645 |
0.79 |
CC(O)(CCN)c1ccccc1 |
|
| MolPort-001-913-650 |
0.78 |
NC(Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-003-905-856 |
0.78 |
CCC(C)(O)c1cccc2ccccc12 |
|
| MolPort-028-949-669 |
0.78 |
Cl.CC(C)(N)C(O)c1ccc(Br)cc1 |
|
| MolPort-014-788-755 |
0.78 |
CC(C)C(C)(O)c1cccc2ccccc12 |
|
| MolPort-003-909-804 |
0.78 |
CCC(O)(CC)c1ccccc1 |
|
| MolPort-008-486-127 |
0.78 |
CC(C)(N)C(O)c1ccc(F)cc1 |
|
| MolPort-013-382-825 |
0.78 |
OC1(CC1)c1ccccc1 |
|
| MolPort-046-672-048 |
0.78 |
CCc1ccc(cc1)C(C)[C@H](C)N |
|
| MolPort-009-198-047 |
0.78 |
NCCc1ccc(CO)cc1 |
|
| MolPort-003-911-656 |
0.78 |
CCC(C)(O)c1ccc2ccccc2c1 |
|
| MolPort-006-117-065 |
0.78 |
Cl.CCN(C)C(C)C(O)c1ccccc1 |
|
| MolPort-003-735-197 |
0.78 |
Cc1ccc(CC(C)(C)N)cc1 |
|
| MolPort-046-672-033 |
0.78 |
C[C@@H](N)C(C)c1ccc(C)cc1 |
|
| MolPort-022-596-965 |
0.78 |
NCCC(O)c1cccc2ccccc12 |
|
| MolPort-046-651-379 |
0.78 |
CC(C)Cc1ccc(cc1)[C@@H](C)CN |
|
| MolPort-046-672-048 |
0.78 |
CCc1ccc(cc1)C(C)[C@H](C)N |
|
| MolPort-046-666-315 |
0.78 |
CC(C)Cc1ccc(cc1)[C@H](C)CN |
|
| MolPort-022-462-737 |
0.78 |
CC(N)C(O)c1ccccc1O |
|
| MolPort-046-653-359 |
0.78 |
C[C@H](N)C(C)c1ccc(C)cc1 |
|
| MolPort-046-651-584 |
0.78 |
CCc1ccc(cc1)C(C)[C@@H](C)N |
|
| MolPort-044-203-094 |
0.78 |
Cl.Cl.CC(N)C(N)C(O)c1ccccc1 |
|
| MolPort-046-651-586 |
0.78 |
CC(C)c1ccc(cc1)C(C)[C@@H](C)N |
|
| MolPort-035-935-978 |
0.78 |
NCC(O)(CO)c1ccccc1 |
|
| MolPort-029-907-847 |
0.78 |
Cl.Cc1cccc(CC(N)CO)c1 |
|
| MolPort-028-949-669 |
0.78 |
Cl.CC(C)(N)C(O)c1ccc(Br)cc1 |
|
| MolPort-046-660-959 |
0.78 |
CC(C)c1ccc(cc1)C(C)[C@H](C)N |
|
| MCULE-7760530136 |
0.78 |
O1[C@H](C2C=C(O)C(=C(O)C=2)O)[C@H](OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O |
|
| MCULE-9913176697 |
0.78 |
OC1C=C2C(CC(C(C3C=CC(O)=C(O)C=3)O2)OC(C2C=C(O)C(O)=C(O)C=2)=O)=C(O)C=1 |
|
| MCULE-7845274541 |
0.78 |
C1(=O)C(OC(C)=O)C(C2=CC=C(C(OC(C)=O)=C2)OC(C)=O)OC2C=C(OC(C)=O)C=C(O)C1=2 |
|
| MCULE-1523399872 |
0.78 |
C1(O)C(CC(C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-2467245336 |
0.78 |
C1(O)=CC(O)=C2C(O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](C2)OC(=O)C2C=C(O)C(O)=C(O)C=2)=C1 |
|
| MCULE-7268905540 |
0.78 |
C12=C(C)C=C(C=C1C(CC(C1=CC=C(C(OC)=C1)OC)O2)=O)C |
|
| MCULE-6382811837 |
0.78 |
O1[C@H]([C@H](O)CC2C(=CC(OC)=CC1=2)OC)C1C=CC(=C(OC)C=1)OC |
|
| MCULE-9218975393 |
0.78 |
[C@H]1([C@@H](O)[C@@H](C2=CC=C(O)C=C2O1)O)C1C=CC(O)=C(O)C=1 |
|
| MCULE-3935146797 |
0.78 |
[C@@H]1([C@H](O)[C@H](C2=CC=C(O)C=C2O1)O)C1C=CC(O)=C(O)C=1 |
|
| MCULE-8110076741 |
0.78 |
C1=C(C=C2C(C[C@@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)[C@@H](C3=CC=C(C(O)=C3)O)O2)=C1O)O |
|
| MCULE-3341525983 |
0.78 |
C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O |
|
| MCULE-9046067244 |
0.78 |
C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O |
|
| MCULE-8926090259 |
0.78 |
C1(OC)C(O)=C2O[C@H](CC(C2=C(O)C=1)=O)C1C(O)=CC=CC=1 |
|
| MCULE-6273466258 |
0.78 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-2163904316 |
0.78 |
C1(O)C=C2C(C(CC(C3=CC(OC)=C(O)C=C3)O2)=O)=C(C=1C/C=C(\C)/C)O |
|
| MCULE-1925476027 |
0.78 |
C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1 |
|
| MCULE-4102972705 |
0.78 |
C12C3C=CC=CC=3C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2 |
|
| MCULE-9752626908 |
0.78 |
O1C(C2C=C(O)C(=C(O)C=2)O)C(OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O |
|
| MCULE-8739063782 |
0.78 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-6777649457 |
0.78 |
C12C=C(C)C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2 |
|
| MCULE-1366630724 |
0.78 |
C1(OC)C=C2O[C@H](C3C=CC(O)=C(OC)C=3)[C@H](O)CC2=C(OC)C=1 |
|
| MCULE-8215821193 |
0.78 |
C1C2=C(C[C@@H]([C@@H](O2)C2C=C(O)C(O)=C(O)C=2)OC(C2C=C(O)C(O)=C(O)C=2)=O)C(O)=CC=1O |
|
| MCULE-4110327431 |
0.78 |
[C@@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1 |
|
| MCULE-9356975267 |
0.78 |
C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)CC2=C(O)C=1 |
|
| MCULE-3978866251 |
0.78 |
[C@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1 |
|
| MolPort-003-936-622 |
0.78 |
N[C@@H](Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-046-651-584 |
0.78 |
CCc1ccc(cc1)C(C)[C@@H](C)N |
|
| MolPort-013-402-238 |
0.78 |
CCC(O)c1cccc2ccccc12 |
|
| MolPort-046-672-033 |
0.78 |
C[C@@H](N)C(C)c1ccc(C)cc1 |
|
| MolPort-046-660-959 |
0.78 |
CC(C)c1ccc(cc1)C(C)[C@H](C)N |
|
| MolPort-046-651-586 |
0.78 |
CC(C)c1ccc(cc1)C(C)[C@@H](C)N |
|
| MolPort-046-653-359 |
0.78 |
C[C@H](N)C(C)c1ccc(C)cc1 |
|
| MolPort-006-013-404 |
0.78 |
CC(N)C(O)c1ccc(F)cc1 |
|
| MolPort-046-651-379 |
0.78 |
CC(C)Cc1ccc(cc1)[C@@H](C)CN |
|
| MolPort-022-462-737 |
0.78 |
CC(N)C(O)c1ccccc1O |
|
| MolPort-044-203-094 |
0.78 |
Cl.Cl.CC(N)C(N)C(O)c1ccccc1 |
|
| MolPort-005-935-622 |
0.78 |
Cl.CC(N)C(O)c1ccc(Cl)cc1 |
|
| MolPort-035-935-978 |
0.78 |
NCC(O)(CO)c1ccccc1 |
|
| MolPort-014-788-758 |
0.78 |
CC(C)C(C)(O)c1ccc2ccccc2c1 |
|
| MolPort-003-936-623 |
0.78 |
N[C@H](Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-046-666-315 |
0.78 |
CC(C)Cc1ccc(cc1)[C@H](C)CN |
|
| MolPort-008-568-410 |
0.78 |
CCC(O)(CN)c1ccc(Br)cc1 |
|
| MolPort-022-596-965 |
0.78 |
NCCC(O)c1cccc2ccccc12 |
|
| MolPort-029-907-847 |
0.78 |
Cl.Cc1cccc(CC(N)CO)c1 |
|
| MolPort-013-402-554 |
0.78 |
CCC(O)c1ccc2ccccc2c1 |
|
| MolPort-003-733-069 |
0.78 |
CC(N)Cc1ccc(cc1)C(C)C |
|
| MolPort-001-779-612 |
0.77 |
NCC(CCO)c1ccccc1 |
|
| MolPort-003-748-953 |
0.77 |
Cc1ccccc1C(O)CN |
|
| MolPort-023-313-633 |
0.77 |
CC(C)(CO)C(CN)c1ccccc1 |
|
| MolPort-046-650-649 |
0.77 |
C[C@@H](CN)c1cccc(c1)C1CC1 |
|
| MolPort-046-659-039 |
0.77 |
C[C@H](CN)c1cccc(c1)C1CC1 |
|
| MolPort-013-332-121 |
0.77 |
CC(N)C(C)(C)c1ccccc1 |
|
| MolPort-020-959-986 |
0.77 |
CC(N)C(C)c1ccccc1 |
|
| MolPort-046-650-649 |
0.77 |
C[C@@H](CN)c1cccc(c1)C1CC1 |
|
| MolPort-046-659-039 |
0.77 |
C[C@H](CN)c1cccc(c1)C1CC1 |
|
| MolPort-023-313-633 |
0.77 |
CC(C)(CO)C(CN)c1ccccc1 |
|
| MolPort-020-959-986 |
0.77 |
CC(N)C(C)c1ccccc1 |
|
| MCULE-5229560297 |
0.77 |
O[C@H]1[C@H](C2C3O[C@@H]([C@H](CC=3C(O)=CC=2O)O)C2C=C(O)C(O)=CC=2)C2C(=CC(=CC=2O[C@@H]1C1C=C(O)C(O)=CC=1)O)O |
|
| MCULE-3334832041 |
0.77 |
C12C=C(OC)C=CC=1C(CC(C1C=CC=C(OC)C=1OC)O2)=O |
|
| MCULE-4827438323 |
0.77 |
C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1CC1C(O)=CC=CC=1 |
|
| MCULE-8465550177 |
0.77 |
C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@H](O)C(=O)C2=C(OC)C=1 |
|
| MCULE-7364169831 |
0.77 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1 |
|
| MCULE-2360599707 |
0.77 |
O[C@H]1[C@H](C2=C(O)C=C(O)C3=C2O[C@H](C2C=CC(O)=C(O)C=2)[C@@H](C3)O)C2C(=CC(=CC=2O)O)O[C@@H]1C1C=CC(O)=C(O)C=1 |
|
| MCULE-3899679930 |
0.77 |
C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1 |
|
| MCULE-7062463801 |
0.77 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1 |
|
| MCULE-4879610005 |
0.77 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1 |
|
| MCULE-9602960797 |
0.77 |
C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-7161357590 |
0.77 |
[C@@H]1([C@H](O)C(C2C=CC=CC=2O1)=O)C1=CC=C(Cl)C=C1 |
|
| MCULE-5996392590 |
0.77 |
C1(O)C(OC2C(=C(O)C3=C(C=2)OC(C2C=CC(O)=CC=2)C23OC3C(C2=O)=C(O)C=C(O)C=3)C1)C1C=CC(O)=C(O)C=1 |
|
| MCULE-1090625056 |
0.77 |
O[C@@H]1[C@@H](C2=CC=C(O)C=C2)OC2C(=C(C(C/C=C(\C)/CC/C=C(\C)/C)=C(O)C=2)O)C1=O |
|
| MCULE-8743190189 |
0.77 |
C12C(=CC=CC=1OC(CC2=O)C1=CC=CC=C1)OC |
|
| MCULE-6331583005 |
0.77 |
O1C(C2C=CC(=CC=2)O)CC(C2C=CC=CC=21)=O |
|
| MCULE-8847685016 |
0.77 |
COC1C=C(O)C(OC)=C2C=1C(CC(C1C=CC=CC=1)O2)=O |
|
| MCULE-7103143686 |
0.77 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-8933677756 |
0.77 |
C1(O)C(C[C@@H](CCC(O)(C)C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@H](O)C(=O)C2=C(OC)C=1 |
|
| MCULE-5742809714 |
0.77 |
C1(OC)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1O |
|
| MCULE-4193314774 |
0.77 |
OC1=C2C(C[C@@H](C3C=CC=CC=3)OC2=C(OC)C(OC)=C1)=O |
|
| MCULE-8473479842 |
0.77 |
OC1C(C/C=C(\C)/C)=CC(=CC=1OC)C1OC2C(C(=O)C1)=C(C=C(C=2)O)O |
|
| MCULE-9922758733 |
0.76 |
C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MCULE-9581242889 |
0.76 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1 |
|
| MCULE-2424476488 |
0.76 |
C12C=C(O)C=CC=1OC(CC2=O)C1=CC=CC=C1 |
|
| MCULE-8810069198 |
0.76 |
C12C(OC(C)=O)=CC(=CC=1OC(CC2=O)C1C=CC(=C(OCC2C=CC=CC=2)C=1)OCC1C=CC=CC=1)OC(C)=O |
|
| MCULE-5357027007 |
0.76 |
C1=C2OC(C3=CC=C(OC)C=C3)CC(=O)C2=CC=C1 |
|
| MCULE-2349308709 |
0.76 |
CC1=CC2=C(OC(C3=CC4=C(OCCCCO4)C=C3)CC2=O)C=C1 |
|
| MCULE-1243164622 |
0.76 |
C12C=C(OC)C=CC=1OC(C1=CC=C(OC)C=C1)CC2=O |
|
| MCULE-6674323180 |
0.76 |
C12=CC(OC)=CC=C1C(=O)CC(C1=CC=C(C=C1)C(O)=O)O2 |
|
| MCULE-6451111457 |
0.76 |
C12C=C(O)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1 |
|
| MCULE-5423915532 |
0.76 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-4054125595 |
0.76 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](O)CC2=C(O)C=1 |
|
| MCULE-9480249121 |
0.76 |
C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCO2)C=1 |
|
| MCULE-3987657618 |
0.76 |
C1(O)C=C2O[C@@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1 |
|
| MCULE-7064559962 |
0.76 |
C1(O)C=C2OC(O)(C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-9862512162 |
0.76 |
[C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=CC(O)=C2C[C@H]1O |
|
| MCULE-6668187578 |
0.76 |
C(C1C(O)=CC(O)=C2C=1O[C@H](C1C=CC=CC=1)CC2=O)C1=C(O)C=CC=C1 |
|
| MCULE-5875158888 |
0.76 |
C1(=O)C(OC(C)=O)C(C2C=CC(=C(OC(C)=O)C=2)OC(C)=O)OC2=CC(OC(C)=O)=CC(OC(C)=O)=C12 |
|
| MolPort-002-507-409 |
0.76 |
N[C@@H](CO)[C@@H](O)c1ccc(N)cc1 |
|
| MolPort-006-013-413 |
0.76 |
CC(N)C(O)c1cccc(O)c1 |
|
| MolPort-028-753-632 |
0.76 |
NC(CO)C(O)c1ccc(N)cc1 |
|
| MolPort-008-547-124 |
0.76 |
CCC(O)(CN)c1ccc(Cl)cc1 |
|
| MolPort-006-147-719 |
0.76 |
OS(O)(=O)=O.CN[C@@H](C)[C@H](O)c1ccccc1.CN[C@@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-011-284-680 |
0.76 |
COCC(N)Cc1ccccc1 |
|
| MolPort-028-950-167 |
0.76 |
Cl.CCC(O)(CN)c1ccc(Cl)cc1 |
|
| MolPort-046-689-975 |
0.76 |
[2H]C([2H])([2H])N(CCO)[C@@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-039-241-315 |
0.76 |
Cl.Cc1ccc(CC(N)CO)cc1C |
|
| MolPort-035-689-763 |
0.76 |
Cl.NCCc1ccc(CO)cc1 |
|
| MolPort-002-511-211 |
0.76 |
C[C@@H]([C@H](O)c1ccccc1)N(C)CCO |
|
| MolPort-002-818-828 |
0.76 |
CN[C@H](C#N)[C@H](O)c1ccccc1 |
|
| MolPort-014-795-222 |
0.76 |
CCCc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-039-241-315 |
0.76 |
Cl.Cc1ccc(CC(N)CO)cc1C |
|
| MolPort-008-604-765 |
0.76 |
CCC(O)c1ccc(CC(C)C)cc1 |
|
| MolPort-008-545-725 |
0.76 |
CCC(O)c1ccc(CC)cc1 |
|
| MolPort-002-134-095 |
0.76 |
CC(C)C(O)c1ccc(C)cc1 |
|
| MolPort-011-893-308 |
0.76 |
CCC(C)(O)c1cccc(C)c1 |
|
| MolPort-008-546-644 |
0.76 |
CCC(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-001-793-321 |
0.76 |
CCC(O)c1ccc(C)cc1 |
|
| MolPort-008-645-376 |
0.76 |
Cc1ccc(cc1)C(O)C(C)(C)C |
|
| MolPort-003-659-965 |
0.76 |
CCC(C)(O)c1ccc(C)cc1 |
|
| MolPort-012-949-766 |
0.76 |
CC(C)C(C)(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-008-643-845 |
0.76 |
CCC(O)c1cccc(C)c1 |
|
| MolPort-012-949-764 |
0.76 |
CCC(C)(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-001-794-498 |
0.76 |
COC[C@@H](N)Cc1ccccc1 |
|
| MolPort-038-941-833 |
0.76 |
COC[C@H](N)Cc1ccccc1 |
|
| MolPort-008-482-926 |
0.76 |
CC(C)(C)c1ccc(cc1)C(O)CCN |
|
| MolPort-039-239-860 |
0.76 |
Cl.Cl.NC(CO)Cc1cccc(CC(N)CO)c1 |
|
| MolPort-011-893-275 |
0.76 |
CC(C)C(C)(O)c1ccc(C)cc1 |
|
| MolPort-008-604-586 |
0.76 |
CCCc1ccc(cc1)C(O)CC |
|
| MolPort-011-893-310 |
0.76 |
CC(C)C(C)(O)c1cccc(C)c1 |
|
| MolPort-008-644-312 |
0.76 |
CCC(O)c1cc(C)cc(C)c1 |
|
| MolPort-014-795-102 |
0.76 |
CCC(C)(O)c1ccc(cc1)C(C)C |
|
| MolPort-035-779-182 |
0.76 |
CCC(C)(O)c1ccc(CC(C)C)cc1 |
|
| MolPort-014-795-220 |
0.76 |
CCCc1ccc(cc1)C(C)(O)CC |
|
| MolPort-046-674-990 |
0.76 |
Cl.C[C@@H](N)Cc1ccc(cc1)C(C)(C)C |
|
| MolPort-014-879-126 |
0.76 |
CCc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-014-788-737 |
0.76 |
CCC(O)(CC)c1cccc2ccccc12 |
|
| MolPort-046-674-219 |
0.76 |
Cl.CC(C)Cc1ccc(CCN)cc1 |
|
| MolPort-014-461-244 |
0.76 |
CC(C)C(C)(O)c1cc(C)cc(C)c1 |
|
| MolPort-014-461-242 |
0.76 |
CCC(C)(O)c1cc(C)cc(C)c1 |
|
| MolPort-014-788-740 |
0.76 |
CCC(O)(CC)c1ccc2ccccc2c1 |
|
| MolPort-014-795-104 |
0.76 |
CC(C)c1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-035-778-974 |
0.76 |
CC(C)Cc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-014-879-125 |
0.76 |
CCc1ccc(cc1)C(C)(O)CC |
|
| MolPort-035-689-763 |
0.76 |
Cl.NCCc1ccc(CO)cc1 |
|
| MolPort-008-546-075 |
0.76 |
CCC(O)c1ccc(cc1)C(C)C |
|
| MolPort-046-689-975 |
0.76 |
[2H]C([2H])([2H])N(CCO)[C@@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-046-674-219 |
0.76 |
Cl.CC(C)Cc1ccc(CCN)cc1 |
|
| MolPort-038-941-833 |
0.76 |
COC[C@H](N)Cc1ccccc1 |
|
| MolPort-039-239-860 |
0.76 |
Cl.Cl.NC(CO)Cc1cccc(CC(N)CO)c1 |
|
| MolPort-035-778-974 |
0.76 |
CC(C)Cc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-028-950-167 |
0.76 |
Cl.CCC(O)(CN)c1ccc(Cl)cc1 |
|
| MolPort-035-779-182 |
0.76 |
CCC(C)(O)c1ccc(CC(C)C)cc1 |
|
| MolPort-046-674-990 |
0.76 |
Cl.C[C@@H](N)Cc1ccc(cc1)C(C)(C)C |
|
| MolPort-028-753-632 |
0.76 |
NC(CO)C(O)c1ccc(N)cc1 |
|
| MCULE-4493065840 |
0.76 |
C12=CC(OC)=CC=C1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC |
|
| MCULE-2685313130 |
0.76 |
O1C2C=CC=CC=2C(CC1C1C=CC2=C(OCCCCO2)C=1)=O |
|
| MCULE-7028658249 |
0.76 |
C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)C[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O |
|
| MCULE-7842380240 |
0.76 |
C(C1C(O)=C(CC2C(O)=CC=CC=2)C(O)=C2C=1O[C@H](C1C=CC=CC=1)CC2=O)C1=C(O)C=CC=C1 |
|
| MCULE-4065402213 |
0.76 |
C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC |
|
| MCULE-8750784705 |
0.75 |
C12C(=O)C[C@H](OC=1C=C(C(C/C=C(/C)\C)=C2O)O)C1C=CC=CC=1 |
|
| MCULE-5717525103 |
0.75 |
C12OC(C)(C)CC(=O)C1=CC=C(OCC1C=CC=C3C=CC=CC=13)C=2C |
|
| MCULE-9355206787 |
0.75 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)C(=O)C2=C(O)C=1 |
|
| MCULE-1883133712 |
0.75 |
C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1C=CC=CC=1 |
|
| MCULE-7506688119 |
0.75 |
C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1=CC=C(C=C1)OC |
|
| MCULE-1448234011 |
0.75 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-8148398497 |
0.75 |
[C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OC(=O)C)C1C=CC=CC=1 |
|
| MCULE-1702737025 |
0.75 |
C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(OC)C=1 |
|
| MCULE-9566890994 |
0.75 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@H](OC(=O)C3C=C(OC)C(O)=C(O)C=3)CC2=C(O)C=1 |
|
| MCULE-4221565922 |
0.75 |
C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@H](OC(=O)C3C=C(OC)C(O)=C(O)C=3)CC2=C(O)C=1 |
|
| MCULE-1313319901 |
0.75 |
C1(O)C=C2OC(C3C=CC(O)=C(O)C=3)C(OC3C(O)C(O)C(O)CO3)C(=O)C2=C(O)C=1 |
|
| MCULE-2776613173 |
0.75 |
C12C=CC(C)=CC=1C(=O)CC(C1C=CC=CC=1)O2 |
|
| MCULE-9485581712 |
0.75 |
C1(O)C=C2C(C(CC(C3C=CC(O)=C(C/C=C(\C)/C)C=3)O2)=O)=C(O)C=1 |
|
| MCULE-4382912006 |
0.75 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1 |
|
| MolPort-038-384-251 |
0.75 |
CNC[C@H](O)c1ccccc1 |
|
| MolPort-009-197-150 |
0.75 |
CC(C)(N)Cc1ccc2ccccc2c1 |
|
| MolPort-044-548-611 |
0.75 |
CNC[C@@H](O)c1ccccc1 |
|
| MolPort-046-203-382 |
0.75 |
Cl.CC(c1ccccc1)C(C)(C)N |
|
| MolPort-008-751-184 |
0.75 |
COC(CN)c1ccccc1 |
|
| MolPort-003-749-158 |
0.75 |
CNCC(C)(O)c1ccccc1 |
|
| MolPort-016-732-001 |
0.75 |
COC(C)(CN)c1ccccc1 |
|
| MolPort-008-510-154 |
0.75 |
CN(C)CC(O)c1ccccc1 |
|
| MolPort-004-323-272 |
0.75 |
CC(N)Cc1ccc2ccccc2c1 |
|
| MolPort-035-758-925 |
0.75 |
CC(C)[C@H](CN)c1ccccc1 |
|
| MolPort-001-791-511 |
0.75 |
CNCC(O)c1ccccc1 |
|
| MolPort-002-468-647 |
0.75 |
CCC(CN)c1ccccc1 |
|
| MolPort-005-312-537 |
0.75 |
CC(C)C(CN)c1ccccc1 |
|
| MolPort-002-509-732 |
0.75 |
CNC[C@](C)(O)c1ccccc1 |
|
| MolPort-044-548-611 |
0.75 |
CNC[C@@H](O)c1ccccc1 |
|
| MolPort-038-384-251 |
0.75 |
CNC[C@H](O)c1ccccc1 |
|
| MolPort-035-758-925 |
0.75 |
CC(C)[C@H](CN)c1ccccc1 |
|
| MolPort-046-203-382 |
0.75 |
Cl.CC(c1ccccc1)C(C)(C)N |
|
| MCULE-7439794905 |
0.74 |
C12C=C(OC)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1 |
|
| MCULE-3436478692 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-9858151978 |
0.74 |
C12C(C/C=C(/C)\C)=C(O)C=C(O)C=1C(CC(C1=CC=CC=C1)O2)=O |
|
| MCULE-1354717254 |
0.74 |
C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCCO2)=C1 |
|
| MCULE-7927912257 |
0.74 |
C1(C=C2OC(C3C=CC(=CC=3)O)C(C3C(C4C=CC(O)=CC=4)OC4C(C3=O)=C(O)C=C(O)C=4)C(C2=C(O)C=1)=O)O |
|
| MCULE-1693566586 |
0.74 |
C12C(C/C=C(/C)\C)=C(O)C=C(O)C=1C(C[C@@H](C1=CC=CC=C1)O2)=O |
|
| MCULE-3925941144 |
0.74 |
O1C(C2C=CC=CC=2)CC(C2C=CC=CC=21)=O |
|
| MCULE-4241987649 |
0.74 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1 |
|
| MCULE-8081389858 |
0.74 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=CC=3)CC(=O)C2=C(OC(=O)C)C=1 |
|
| MCULE-5659982548 |
0.74 |
[C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=C(C/C=C(\C)/C)C=C2C(=O)C1 |
|
| MCULE-3002934523 |
0.74 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-9919244870 |
0.74 |
C1(C2OC3C(C/C=C(\C)/C)=C(O)C=C(O)C=3C(C2)=O)=CC=C(O)C=C1 |
|
| MCULE-6062655870 |
0.74 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=C(OC)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-6234117773 |
0.74 |
C1=C(C=C2C(C([C@@H]([C@@H](C3=CC=C(C(O)=C3)O)O2)O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)=O)=C1O)O |
|
| MCULE-3140585141 |
0.74 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)C(OC)=O |
|
| MCULE-3625538935 |
0.74 |
C12C=C(OC)C=CC=1OC(CC2=O)C1=CC=CC=C1 |
|
| MCULE-3686223068 |
0.74 |
C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C2=C(O)C=1 |
|
| MCULE-1097395119 |
0.74 |
C1C=C2C(OC(CC2=O)C2C=CC(C3C=CC=CC=3)=CC=2)=CC=1O |
|
| MCULE-4391957723 |
0.74 |
C1(O)C=C2OCC(CC3C=CC(O)=C(O)C=3)C(=O)C2=CC=1 |
|
| MCULE-1018595313 |
0.74 |
O(C)C1C=CC(C2OC3C(C(=O)C2C2C(OC4C(C2=O)=C(O)C=C(O)C=4)C2C=CC(OC)=CC=2)=C(O)C=C(O)C=3)=CC=1 |
|
| MCULE-8939875451 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-9748713051 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-1804962504 |
0.74 |
[C@H]1(OC2=C(C=CC=C2)C(=O)[C@H]1OC(=O)CCC)C1=CC=CC=C1 |
|
| MCULE-4071615581 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-9352490355 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-3047713071 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-4867181308 |
0.74 |
C1=C(C2=C(C=C1O)O[C@@H]([C@@H](O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O1)C2=O)C1=CC=C(C(O)=C1)O)O |
|
| MCULE-5215717105 |
0.74 |
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-2275149602 |
0.74 |
C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1 |
|
| MCULE-8876698541 |
0.74 |
C1C=C2C(=CC=1)C(=O)C[C@@H](C1C=CC=CC=1)O2 |
|
| MCULE-4652067575 |
0.74 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1C/C=C(\C)/C |
|
| MCULE-9260449258 |
0.74 |
C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3OC)CC(=O)C2=C(OC)C=1 |
|
| MCULE-3613127722 |
0.74 |
O(C)C1=CC=C(C2OC3C(C(=O)C2C2C(OC4C(C2=O)=C(O)C=C(O)C=4)C2C=CC(O)=CC=2)=C(O)C=C(C=3)O)C=C1 |
|
| MCULE-7590247408 |
0.74 |
O[C@@H]1[C@@H](O)[C@H](O)[C@H](OC1C1C(O)=C2C(=O)[C@H](O)[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)CO |
|
| MCULE-4551144105 |
0.74 |
C1(O)C=C2C(C(CC(C3C=CC(O)=C(C/C=C(/C)\C)C=3)O2)=O)=CC=1 |
|
| MCULE-3864605326 |
0.74 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-011-910-897 |
0.74 |
CCC(O)(CC)c1cccc(C)c1 |
|
| MolPort-002-856-555 |
0.74 |
NC(Cc1ccc(CO)cc1)C(O)=O |
|
| MolPort-035-779-971 |
0.74 |
CCC(O)(CC)c1ccc(CC(C)C)cc1 |
|
| MolPort-014-795-103 |
0.74 |
CCC(O)(CC)c1ccc(cc1)C(C)C |
|
| MolPort-028-673-140 |
0.74 |
CC(C)(CO)[C@@H](O)c1ccccc1 |
|
| MolPort-014-461-243 |
0.74 |
CCC(O)(CC)c1cc(C)cc(C)c1 |
|
| MolPort-012-949-765 |
0.74 |
CCC(O)(CC)c1ccc(cc1)C(C)(C)C |
|
| MolPort-046-651-585 |
0.74 |
CCC([C@@H](C)N)c1ccc(C)cc1 |
|
| MolPort-014-795-221 |
0.74 |
CCCc1ccc(cc1)C(O)(CC)CC |
|
| MolPort-027-640-714 |
0.74 |
Cl.NCCc1ccc(cc1)C1CC1 |
|
| MolPort-044-649-380 |
0.74 |
N[C@H]1Cc2ccccc2[C@H]1O |
|
| MolPort-001-790-998 |
0.74 |
N[C@@H]([C@H](O)c1ccccc1)C(O)=O |
|
| MolPort-011-910-898 |
0.74 |
CCC(O)(CC)c1ccc(C)cc1 |
|
| MolPort-044-198-516 |
0.74 |
CC(C(O)c1ccccc1)N(C)C=O |
|
| MolPort-001-761-193 |
0.74 |
NC1Cc2ccccc2C1O |
|
| MolPort-000-006-317 |
0.74 |
NC(C(O)c1ccccc1)C(O)=O |
|
| MolPort-000-731-972 |
0.74 |
[I-].C[C@@H]([C@H](O)c1ccccc1)[N+](C)(C)CCO |
|
| MolPort-008-512-887 |
0.74 |
CC(C)(C)c1ccc(cc1)C1(CN)CC1 |
|
| MolPort-039-033-024 |
0.74 |
[Cl-].CC(C)[NH2+]C(C)C(O)c1ccc(C)cc1 |
|
| MolPort-008-465-901 |
0.74 |
Cc1ccccc1CC(N)CO |
|
| MolPort-023-279-153 |
0.74 |
CN[C@H](CO)Cc1ccccc1 |
|
| MolPort-022-152-060 |
0.74 |
NC1(Cc2ccccc2)COC1 |
|
| MolPort-001-846-656 |
0.74 |
CNC(CO)Cc1ccccc1 |
|
| MolPort-046-660-536 |
0.74 |
CCC([C@H](C)N)c1ccc(C)cc1 |
|
| MolPort-028-673-403 |
0.74 |
CC(C)(CO)[C@H](O)c1ccccc1 |
|
| MolPort-012-946-974 |
0.74 |
CCc1ccc(cc1)C(O)(CC)CC |
|
| MolPort-002-485-417 |
0.74 |
CC(C)(CO)C(O)c1ccccc1 |
|
| MolPort-020-000-486 |
0.74 |
O.N[C@@H](C(O)c1ccccc1)C(O)=O |
|
| MolPort-023-279-153 |
0.74 |
CN[C@H](CO)Cc1ccccc1 |
|
| MolPort-028-673-403 |
0.74 |
CC(C)(CO)[C@H](O)c1ccccc1 |
|
| MolPort-028-673-140 |
0.74 |
CC(C)(CO)[C@@H](O)c1ccccc1 |
|
| MolPort-046-660-536 |
0.74 |
CCC([C@H](C)N)c1ccc(C)cc1 |
|
| MolPort-035-779-971 |
0.74 |
CCC(O)(CC)c1ccc(CC(C)C)cc1 |
|
| MolPort-027-640-714 |
0.74 |
Cl.NCCc1ccc(cc1)C1CC1 |
|
| MolPort-046-651-585 |
0.74 |
CCC([C@@H](C)N)c1ccc(C)cc1 |
|
| MolPort-022-152-060 |
0.74 |
NC1(Cc2ccccc2)COC1 |
|
| MolPort-020-000-486 |
0.74 |
O.N[C@@H](C(O)c1ccccc1)C(O)=O |
|
| MolPort-044-649-380 |
0.74 |
N[C@H]1Cc2ccccc2[C@H]1O |
|
| MolPort-039-033-024 |
0.74 |
[Cl-].CC(C)[NH2+]C(C)C(O)c1ccc(C)cc1 |
|
| MolPort-044-198-516 |
0.74 |
CC(C(O)c1ccccc1)N(C)C=O |
|
| MCULE-6813410114 |
0.73 |
C12=CC(OCC3C=CC=CC=3)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC=CC=1 |
|
| MCULE-7988809823 |
0.73 |
C1(OC)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-2611502602 |
0.73 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC(=O)C)C=1 |
|
| MCULE-7513860584 |
0.73 |
C1(OC)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-2851603971 |
0.73 |
C1(O)C=C2OCC(CC3C=CC(OC)=C(O)C=3)C(=O)C2=C(O)C=1 |
|
| MCULE-1880910154 |
0.73 |
[C@H]1(C2=CC=C(O)C=C2)OC2=CC(OC)=C(C/C=C(\C)/C)C=C2C(=O)C1 |
|
| MCULE-9617502889 |
0.73 |
C1(OC)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-3021933663 |
0.73 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1 |
|
| MCULE-4810068413 |
0.73 |
C1(O)C(C/C=C(\C)/C)=C2OC(C3C=CC4OC(C)(C)C(O)C(O)C=4C=3)CC(=O)C2=CC=1 |
|
| MCULE-9583531134 |
0.73 |
C1(OC)C=C2O[C@H](C3C=CC4OCOC=4C=3)[C@H](O)CC2=C(OC)C=1 |
|
| MCULE-6772374144 |
0.73 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC=CC=1 |
|
| MCULE-7018809823 |
0.73 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-2677968878 |
0.73 |
C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-6477005466 |
0.73 |
O=C1C2C(=C(C=C(C=2O)O)[C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C([C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C1O |
|
| MCULE-6612299602 |
0.73 |
C1(O)C=C2O[C@H](C3C=CC(OC)=C(C/C=C(\C)/C)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-7736830441 |
0.73 |
C12OC(CC(=O)C=1C=CC(OCC1=C(C)C=C(C)C=C1C)=C2C)(C)C |
|
| MCULE-6543286448 |
0.73 |
O=C1C2C(=C(C=C(C=2O)O)[C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C([C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C1O |
|
| MCULE-5454789546 |
0.73 |
C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1=CC=C2C(OCCO2)=C1 |
|
| MCULE-3842882003 |
0.73 |
OC1C=CC([C@H]2OC3C(C(=O)C2)=CC(C/C=C(\C)/C)=C(OC)C=3)=CC=1 |
|
| MCULE-4756469832 |
0.73 |
C12C(OC(C)=O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC=CC=1)OC(C)=O |
|
| MCULE-6209828622 |
0.73 |
C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCCCO2)C=1 |
|
| MCULE-3123185458 |
0.73 |
C1(C(=O)C2C=CC(=CC=2OCC2=CC=CC=C2)OC)C(O1)C1=CC=C2C(OCCCO2)=C1 |
|
| MCULE-4959289073 |
0.73 |
O1[C@H](C2=CC=CC=C2)[C@H](O)CC2C=CC(OC)=CC1=2 |
|
| MCULE-1517499241 |
0.73 |
O1[C@H](C2C=CC(=CC=2)C)CC(C2C=CC=CC=21)=O |
|
| MCULE-6359355499 |
0.73 |
C12C=C(OC)C=CC=1O[C@@](CC2=O)([H])C1C=CC2=C(OCCCCO2)C=1 |
|
| MCULE-3956882637 |
0.73 |
C1(CC(=O)C2=C(C=CC=C2)O1)C1C=CC=C(OC)C=1OC |
|
| MCULE-2650174810 |
0.73 |
O(C)C1=C(C=C([C@H]2OC3C(C(=O)C2)=C(C=C(C=3)O)O)C=C1C/C=C(\C)/C)C/C=C(\C)/C |
|
| MCULE-5895803515 |
0.73 |
C1(C2=CC=CC=C2O)CC(C2C=C(O)C=CC=2O1)=O |
|
| MCULE-1651216901 |
0.73 |
C1(=O)CC(C2=CC=C(C=C2)OC)OC2C=C(C)C=C(C)C1=2 |
|
| MolPort-000-716-250 |
0.73 |
[Cl-].C[NH2+]CC(C)(O)c1ccccc1 |
|
| MolPort-008-644-307 |
0.73 |
CCC(C)c1ccc(CO)cc1 |
|
| MolPort-009-757-547 |
0.73 |
Cl.CNC[C@](C)(O)c1ccccc1 |
|
| MolPort-020-915-999 |
0.73 |
OC1(CNC1)c1ccccc1 |
|
| MolPort-014-795-219 |
0.73 |
CCCc1ccc(cc1)C(C)(C)O |
|
| MolPort-005-311-500 |
0.73 |
Cl.COC(CN)c1ccccc1 |
|
| MolPort-005-310-683 |
0.73 |
Cl.CCC(CN)c1ccccc1 |
|
| MolPort-042-684-302 |
0.73 |
Cl.NC(CO)C(O)c1ccc(Cl)cc1 |
|
| MolPort-008-644-306 |
0.73 |
CC(C)Cc1ccc(CO)cc1 |
|
| MolPort-046-660-829 |
0.73 |
CCC([C@@H](C)N)c1ccccc1 |
|
| MolPort-019-906-255 |
0.73 |
Cl.CC(C)(N)Cc1ccc2ccccc2c1 |
|
| MolPort-006-013-395 |
0.73 |
CC(N)C(O)c1cccc(Cl)c1 |
|
| MolPort-004-956-875 |
0.73 |
Cl.NC(C(O)c1ccccc1)C(O)=O |
|
| MolPort-023-329-887 |
0.73 |
N[C@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-003-871-633 |
0.73 |
NC(c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-046-763-641 |
0.73 |
CN[C@H](C)[C@@H](O)c1ccc(F)cc1 |
|
| MolPort-002-510-338 |
0.73 |
C[C@H]([C@H](O)c1ccccc1)N(C)CC#N |
|
| MolPort-020-110-068 |
0.73 |
Cl.CC(N)C(O)c1ccccc1F |
|
| MolPort-023-230-650 |
0.73 |
Cl.NC1Cc2ccccc2C1O |
|
| MolPort-003-936-589 |
0.73 |
N[C@@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-023-048-149 |
0.73 |
CC(C)Cc1ccc(cc1)C(C)(C)O |
|
| MolPort-005-313-538 |
0.73 |
CCCc1ccc(cc1)[C@@H](C)O |
|
| MolPort-026-521-413 |
0.73 |
CCC(C)(C)c1ccc(CO)cc1 |
|
| MolPort-019-906-255 |
0.73 |
Cl.CC(C)(N)Cc1ccc2ccccc2c1 |
|
| MolPort-004-290-206 |
0.73 |
CC(C)Cc1ccc(cc1)C(C)O |
|
| MolPort-002-498-517 |
0.73 |
CCCc1ccc(CO)cc1 |
|
| MolPort-004-290-013 |
0.73 |
CCCc1ccc(cc1)C(C)O |
|
| MolPort-011-426-554 |
0.73 |
CCC(CC)(CN)c1ccccc1 |
|
| MolPort-002-471-570 |
0.73 |
NCC1(CC1)c1ccccc1 |
|
| MolPort-046-660-521 |
0.73 |
CCC([C@H](C)N)c1ccccc1 |
|
| MolPort-026-521-413 |
0.73 |
CCC(C)(C)c1ccc(CO)cc1 |
|
| MolPort-020-915-999 |
0.73 |
OC1(CNC1)c1ccccc1 |
|
| MolPort-023-048-149 |
0.73 |
CC(C)Cc1ccc(cc1)C(C)(C)O |
|
| MolPort-020-110-068 |
0.73 |
Cl.CC(N)C(O)c1ccccc1F |
|
| MolPort-046-660-829 |
0.73 |
CCC([C@@H](C)N)c1ccccc1 |
|
| MolPort-023-230-650 |
0.73 |
Cl.NC1Cc2ccccc2C1O |
|
| MolPort-029-945-606 |
0.73 |
Cl.N[C@@H]1Cc2ccccc2[C@H]1O |
|
| MolPort-029-945-606 |
0.73 |
Cl.N[C@@H]1Cc2ccccc2[C@H]1O |
|
| MolPort-042-684-302 |
0.73 |
Cl.NC(CO)C(O)c1ccc(Cl)cc1 |
|
| MolPort-046-660-521 |
0.73 |
CCC([C@H](C)N)c1ccccc1 |
|
| MolPort-046-763-641 |
0.73 |
CN[C@H](C)[C@@H](O)c1ccc(F)cc1 |
|
| MolPort-023-329-887 |
0.73 |
N[C@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MCULE-9646906067 |
0.72 |
C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-3558918209 |
0.72 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)Br |
|
| MCULE-6030144398 |
0.72 |
O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1C1C(=C2C(=O)C[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)O)CO |
|
| MCULE-9022426858 |
0.72 |
C1(O)C=C2OC(C3C(C/C=C(/C)\C)=C(O)C(O)=C(C/C=C(\C)/C)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-4597198409 |
0.72 |
OC1C(O)C(O)C(OC1C1C(=C2C(=O)CC(C3C=CC(O)=CC=3)OC2=CC=1O)O)CO |
|
| MCULE-2979677001 |
0.72 |
C12=CC(OC)=CC=C1OC(CC2=O)C1C=CC(=CC=1)C |
|
| MCULE-5729797705 |
0.72 |
C12OC(CC(=O)C=1C(OC)=CC(O)=C2C/C=C(\C)/C)C1C=CC(O)=CC=1 |
|
| MCULE-9052045784 |
0.72 |
C1(OC)C(C/C=C(\C)/C)=C2C(C(=O)C[C@H](O2)C2C=CC=CC=2)=C(C=1)OC |
|
| MCULE-3634060795 |
0.72 |
BrC1=CC2=C(OC(C3=CC4=C(OCCO4)C=C3)CC2=O)C=C1 |
|
| MCULE-3686350370 |
0.72 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=C(C/C=C(/C)\C)C(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-3958961905 |
0.72 |
C1(O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-1157112040 |
0.72 |
OC1=C(C=C([C@@H]2OC3=CC(=CC(=C3C(=O)[C@H]2O)O)O)C=C1)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1 |
|
| MCULE-7376385188 |
0.72 |
C1(=O)C(OC(C)=O)C(OC2C=C(C=C(OC(C)=O)C1=2)OC(C)=O)C1C=CC2=C(C=1)OC(C(COC(C)=O)O2)C1C=CC(=C(OC)C=1)OC(C)=O |
|
| MCULE-7617295584 |
0.72 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-8336811002 |
0.72 |
CC1C2C[C@](O)(C)[C@@H](C3C=CC(O)=C(O)C=3)OC=2C([C@@H]2C3C(=CC(O)=CC=3O)O[C@H](C3C=CC(O)=C(O)C=3)[C@H]2O)=C(O)C=1 |
|
| MCULE-6122035709 |
0.72 |
C12C(=O)CC(C)(C)OC=1C(C)=C(C=C2)OCC1=CC=CC(OC(F)(F)F)=C1 |
|
| MCULE-9522158167 |
0.72 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)C=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-5017083843 |
0.72 |
C1(=O)C(OC(C)=O)[C@@H](C2C=CC3=C(C=2)OC([C@@H](COC(C)=O)O3)C2C=CC(=C(OC)C=2)OC(C)=O)OC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2 |
|
| MCULE-1825001608 |
0.72 |
C1(O)C(C/C=C(/C)\C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MolPort-001-761-030 |
0.72 |
OC(CC#N)c1ccccc1 |
|
| MolPort-001-790-615 |
0.72 |
CCC(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-008-644-308 |
0.72 |
CC(C)C(O)c1ccccc1C |
|
| MolPort-002-051-551 |
0.72 |
CCCC(O)c1ccccc1 |
|
| MolPort-035-780-413 |
0.72 |
CCC(O)c1cccc(c1)C(C)C |
|
| MolPort-035-780-884 |
0.72 |
CC(C)c1cccc(c1)C(C)(O)C(C)C |
|
| MolPort-001-797-938 |
0.72 |
CCCC(C)(O)c1ccccc1 |
|
| MolPort-008-645-229 |
0.72 |
CCCCc1ccc(CCN)cc1 |
|
| MolPort-000-930-655 |
0.72 |
OCc1cccc(c1)C1CC1 |
|
| MolPort-008-643-844 |
0.72 |
CCC(O)c1ccccc1C |
|
| MolPort-025-494-862 |
0.72 |
CCc1cccc(c1)C(C)(O)C(C)C |
|
| MolPort-035-780-415 |
0.72 |
CC(C)C(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-011-893-283 |
0.72 |
CC(C)C(C)(O)c1ccccc1C |
|
| MolPort-011-893-282 |
0.72 |
CCC(C)(O)c1ccccc1C |
|
| MolPort-046-651-376 |
0.72 |
CCCCc1ccc(cc1)[C@@H](C)CN |
|
| MolPort-028-673-388 |
0.72 |
O[C@@H](CC#N)c1ccccc1 |
|
| MolPort-027-632-280 |
0.72 |
CCC(O)c1cccc(CC)c1 |
|
| MolPort-004-290-472 |
0.72 |
CC(C)CC(O)c1ccccc1 |
|
| MolPort-025-494-853 |
0.72 |
CCc1cccc(c1)C(C)(O)CC |
|
| MolPort-008-545-714 |
0.72 |
CCC(N)Cc1ccc(C)cc1 |
|
| MolPort-002-083-678 |
0.72 |
CC(O)(CC#N)c1ccccc1 |
|
| MolPort-001-941-233 |
0.72 |
CC(C#N)C(C)(O)c1ccccc1 |
|
| MolPort-046-153-217 |
0.72 |
Cc1cccc(C)c1C[C@H](N)CO |
|
| MolPort-044-183-017 |
0.72 |
Cl.NC1(Cc2ccccc2)COC1 |
|
| MolPort-022-370-263 |
0.72 |
CC(N)CC(O)c1ccccc1 |
|
| MolPort-002-083-680 |
0.72 |
CC(C)(C#N)C(O)c1ccccc1 |
|
| MolPort-033-440-494 |
0.72 |
Cc1cccc(C)c1CC(N)CO |
|
| MolPort-009-331-644 |
0.72 |
Cc1ccc(cc1C)C1CC1N |
|
| MolPort-046-153-221 |
0.72 |
Cc1cccc(C)c1C[C@@H](N)CO |
|
| MolPort-046-666-309 |
0.72 |
CCCCc1ccc(cc1)[C@H](C)CN |
|
| MolPort-035-778-653 |
0.72 |
CCC(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-035-778-507 |
0.72 |
CCC(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-001-792-988 |
0.72 |
CC(C)(C)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-028-673-125 |
0.72 |
O[C@H](CC#N)c1ccccc1 |
|
| MolPort-046-153-754 |
0.72 |
C[C@H](O)[C@H](O)c1ccccc1 |
|
| MolPort-035-781-567 |
0.72 |
CCC(C)(O)c1cccc(c1)C(C)C |
|
| MolPort-046-153-754 |
0.72 |
C[C@H](O)[C@H](O)c1ccccc1 |
|
| MolPort-027-632-280 |
0.72 |
CCC(O)c1cccc(CC)c1 |
|
| MolPort-033-440-494 |
0.72 |
Cc1cccc(C)c1CC(N)CO |
|
| MolPort-046-651-376 |
0.72 |
CCCCc1ccc(cc1)[C@@H](C)CN |
|
| MolPort-025-494-862 |
0.72 |
CCc1cccc(c1)C(C)(O)C(C)C |
|
| MolPort-046-666-309 |
0.72 |
CCCCc1ccc(cc1)[C@H](C)CN |
|
| MolPort-035-781-567 |
0.72 |
CCC(C)(O)c1cccc(c1)C(C)C |
|
| MolPort-035-780-415 |
0.72 |
CC(C)C(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-035-780-884 |
0.72 |
CC(C)c1cccc(c1)C(C)(O)C(C)C |
|
| MolPort-035-780-413 |
0.72 |
CCC(O)c1cccc(c1)C(C)C |
|
| MolPort-035-778-507 |
0.72 |
CCC(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-035-778-653 |
0.72 |
CCC(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-022-370-263 |
0.72 |
CC(N)CC(O)c1ccccc1 |
|
| MolPort-046-153-217 |
0.72 |
Cc1cccc(C)c1C[C@H](N)CO |
|
| MolPort-044-183-017 |
0.72 |
Cl.NC1(Cc2ccccc2)COC1 |
|
| MolPort-028-673-125 |
0.72 |
O[C@H](CC#N)c1ccccc1 |
|
| MolPort-028-673-388 |
0.72 |
O[C@@H](CC#N)c1ccccc1 |
|
| MolPort-025-494-853 |
0.72 |
CCc1cccc(c1)C(C)(O)CC |
|
| MolPort-046-153-221 |
0.72 |
Cc1cccc(C)c1C[C@@H](N)CO |
|
| MolPort-011-914-000 |
0.71 |
CC(C)(C)C(N)Cc1ccccc1 |
|
| MolPort-004-814-047 |
0.71 |
CC(C)C(N)Cc1ccccc1 |
|
| MolPort-046-736-642 |
0.71 |
Cl.NC1(CCCCC1)C(O)c1ccccc1 |
|
| MolPort-046-763-400 |
0.71 |
Cl.CN[C@H](C)[C@@H](O)c1ccc(O)cc1 |
|
| MolPort-006-013-368 |
0.71 |
CC(N)C(O)c1c(F)cccc1F |
|
| MolPort-044-181-047 |
0.71 |
Cl.CC(C(O)c1ccccc1)N(C)CC#N |
|
| MolPort-044-422-302 |
0.71 |
Cl.CNC(C)Cc1cccc(C)c1 |
|
| MolPort-046-689-977 |
0.71 |
Cl.CN[C@@H](C)[C@H](O)c1ccc(O)cc1 |
|
| MolPort-000-706-980 |
0.71 |
CCCCN(C)[C@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-000-801-525 |
0.71 |
[Cl-].CC(C(O)c1ccccc1)[NH+](C)CC#N |
|
| MolPort-033-481-975 |
0.71 |
CC[C@@H](N)Cc1ccccc1 |
|
| MolPort-042-623-897 |
0.71 |
Cl.CC(C)C(N)C(O)c1ccc(Cl)cc1 |
|
| MolPort-016-583-321 |
0.71 |
Cl.Cc1cccc(CC2(N)CC2)c1 |
|
| MolPort-023-198-773 |
0.71 |
Cl.CC(N)C(O)c1cccc(F)c1 |
|
| MolPort-023-313-943 |
0.71 |
NC(CO)CC(O)c1ccccc1 |
|
| MolPort-009-197-992 |
0.71 |
Cl.NCC1(CC1)c1ccccc1 |
|
| MolPort-020-916-100 |
0.71 |
COCc1ccc(CCN)cc1 |
|
| MolPort-026-047-172 |
0.71 |
CC(O)c1ccc(cc1)C1CC1 |
|
| MolPort-000-930-651 |
0.71 |
OCc1ccc(cc1)C1CC1 |
|
| MolPort-033-481-975 |
0.71 |
CC[C@@H](N)Cc1ccccc1 |
|
| MolPort-046-161-073 |
0.71 |
CC(C)[C@@H](N)Cc1ccccc1 |
|
| MolPort-023-313-943 |
0.71 |
NC(CO)CC(O)c1ccccc1 |
|
| MolPort-034-331-776 |
0.71 |
CC(N=[N+]=[N-])C(O)c1ccc(C)cc1 |
|
| MolPort-035-789-447 |
0.71 |
Cl.NC(CCO)Cc1ccccc1 |
|
| MolPort-023-198-773 |
0.71 |
Cl.CC(N)C(O)c1cccc(F)c1 |
|
| MolPort-046-689-977 |
0.71 |
Cl.CN[C@@H](C)[C@H](O)c1ccc(O)cc1 |
|
| MolPort-042-623-761 |
0.71 |
Cl.CCC(N)C(O)c1ccc(Cl)cc1 |
|
| MolPort-029-939-226 |
0.71 |
Cl.OC1(CNC1)c1ccccc1 |
|
| MolPort-042-623-897 |
0.71 |
Cl.CC(C)C(N)C(O)c1ccc(Cl)cc1 |
|
| MolPort-046-736-642 |
0.71 |
Cl.NC1(CCCCC1)C(O)c1ccccc1 |
|
| MolPort-046-763-400 |
0.71 |
Cl.CN[C@H](C)[C@@H](O)c1ccc(O)cc1 |
|
| MolPort-044-181-047 |
0.71 |
Cl.CC(C(O)c1ccccc1)N(C)CC#N |
|
| MolPort-044-422-302 |
0.71 |
Cl.CNC(C)Cc1cccc(C)c1 |
|
| MolPort-020-168-598 |
0.71 |
Cl.CC(N)C(O)c1c(Cl)cccc1Cl |
|
| MolPort-035-789-447 |
0.71 |
Cl.NC(CCO)Cc1ccccc1 |
|
| MolPort-026-047-172 |
0.71 |
CC(O)c1ccc(cc1)C1CC1 |
|
| MolPort-020-168-598 |
0.71 |
Cl.CC(N)C(O)c1c(Cl)cccc1Cl |
|
| MolPort-042-623-761 |
0.71 |
Cl.CCC(N)C(O)c1ccc(Cl)cc1 |
|
| MolPort-020-916-100 |
0.71 |
COCc1ccc(CCN)cc1 |
|
| MolPort-004-319-880 |
0.71 |
CC(N)Cc1ccc(C)cc1C |
|
| MolPort-004-946-849 |
0.71 |
Cl.CNC(C)[C@@H](O)c1ccc(O)cc1 |
|
| MCULE-6810010607 |
0.71 |
C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MCULE-8960596008 |
0.71 |
C12OC(CC(=O)C=1C(C)=CC(OCC1C=C(C=CC=1C)C)=C2)(C)C |
|
| MCULE-7823431861 |
0.71 |
C1C=C2C(=O)CC(OC2=CC=1)C1C=CC(C(=O)OC)=CC=1 |
|
| MCULE-4510679729 |
0.71 |
C1C(OC)=C2C(=O)C[C@@H](C)OC2=C(C=1O)CCO |
|
| MCULE-5872911488 |
0.71 |
C12C=C(Cl)C=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC |
|
| MCULE-1583442011 |
0.71 |
C1(O)C(C/C=C(/C)\C)=C2O[C@H](C3C=C(C/C=C(/C)\C)C(O)=C(C/C=C(\C)/C)C=3)CC(=O)C2=CC=1 |
|
| MCULE-5025792577 |
0.71 |
C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MCULE-1404315977 |
0.71 |
C1C(=C2C(=O)C[C@H](OC2=CC=1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C1C=C(C(=CC=1)O)O)O |
|
| MCULE-2316302341 |
0.71 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)[C@H](O)C2=CC=1 |
|
| MCULE-4247637636 |
0.71 |
C12C=C(Cl)C=CC=1OC(CC2=O)C1C=CC2=C(OCCO2)C=1 |
|
| MCULE-2220805002 |
0.71 |
C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCCO2)C=1 |
|
| MCULE-4617683717 |
0.71 |
C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C |
|
| MCULE-6814312961 |
0.71 |
C1(C2C=CC=CC=2)(C2C=CC=CC=2)CC(=O)C2=C(C=CC=C2)O1 |
|
| MCULE-4067098142 |
0.71 |
C12C(=C(O)C=CC=1C(=O)C[C@@H](C1C=CC(O)=C(C/C=C(/C)\C)C=1)O2)C/C=C(\C)/C |
|
| MCULE-2660644517 |
0.71 |
C1(C2C=CC=CC=2O)CC(=O)C2C(=CC=CC=2)O1 |
|
| MCULE-7509034065 |
0.71 |
O(C1=C2C(=CC(OC)=C1)O[C@H](C1C=CC(O)=C(OC)C=1)[C@@H](O)C2=O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
|
| MCULE-7586369120 |
0.71 |
C12=C(CCC(C3=CC=CC=C3)O1)C=C(C=O)C(O)=C2C |
|
| MCULE-8583168504 |
0.71 |
C1(O)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CCC2=CC=1 |
|
| MCULE-4861196207 |
0.71 |
[C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@H]1C |
|
| MCULE-7481655024 |
0.71 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1 |
|
| MCULE-4792540517 |
0.71 |
C1(=CC(=C2C(OC(C3=CC=C(C=C3)O)C(O)C2=O)=C1)O)OC1OC(CO)C(O)C(O)C1O |
|
| MolPort-046-161-073 |
0.71 |
CC(C)[C@@H](N)Cc1ccccc1 |
|
| MolPort-008-643-883 |
0.71 |
NNCC(O)c1ccccc1 |
|
| MolPort-029-939-226 |
0.71 |
Cl.OC1(CNC1)c1ccccc1 |
|
| MolPort-003-931-847 |
0.71 |
CCCCN(CCCC)[C@H](C)[C@@H](O)c1ccccc1 |
|
| MolPort-034-331-776 |
0.71 |
CC(N=[N+]=[N-])C(O)c1ccc(C)cc1 |
|
| MolPort-001-790-224 |
0.71 |
CCC(N)Cc1ccccc1 |
|
| MolPort-015-018-386 |
0.71 |
CCC(N)C(C)(C)c1ccccc1 |
|
| MolPort-003-849-659 |
0.70 |
[15NH2][13CH2][13CH](O)c1ccc(O)cc1 |
|
| MolPort-004-969-111 |
0.70 |
N[C@@H](CO)Cc1ccc(O)cc1 |
|
| MolPort-001-758-745 |
0.70 |
Cc1ccc(C[C@@H](N)C(O)=O)cc1 |
|
| MolPort-023-047-584 |
0.70 |
COC(CN)(OC)c1ccccc1 |
|
| MolPort-004-525-352 |
0.70 |
N[C@H](CO)Cc1ccc(O)cc1 |
|
| MolPort-003-990-094 |
0.70 |
CC(C)(C)c1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-003-990-080 |
0.70 |
Cc1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-001-758-818 |
0.70 |
CC(C)(C)c1ccc(C[C@@H](N)C(O)=O)cc1 |
|
| MolPort-001-758-817 |
0.70 |
CC(C)(C)c1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-001-758-746 |
0.70 |
Cc1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-009-198-741 |
0.70 |
CC(C)c1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-042-621-661 |
0.70 |
Cl.OC1(CNC1)c1cccc2ccccc12 |
|
| MolPort-004-340-981 |
0.70 |
CC(C)c1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-000-156-713 |
0.70 |
NC(=O)C(O)c1ccccc1 |
|
| MolPort-042-621-661 |
0.70 |
Cl.OC1(CNC1)c1cccc2ccccc12 |
|
| MolPort-002-052-044 |
0.70 |
NCC(O)c1ccc(O)cc1 |
|
| MolPort-001-760-222 |
0.70 |
OC(=O)C(O)=O.Cc1ccc(cc1)C(O)CN |
|
| MolPort-009-681-083 |
0.70 |
NC(=O)[C@H](O)c1ccccc1 |
|
| MolPort-029-945-099 |
0.70 |
NC(=O)[C@@H](O)c1ccccc1 |
|
| MolPort-023-188-875 |
0.70 |
CC(O)CC(CN)c1ccccc1 |
|
| MolPort-029-527-590 |
0.70 |
Cc1cccc(c1C)C1(CN)CC1 |
|
| MolPort-023-188-875 |
0.70 |
CC(O)CC(CN)c1ccccc1 |
|
| MolPort-035-780-505 |
0.70 |
CCCCc1ccc(cc1)C(O)(CC)CC |
|
| MolPort-023-313-736 |
0.70 |
NCC1(CC1)C(O)c1ccccc1 |
|
| MolPort-035-765-237 |
0.70 |
Cl.Cc1ccc(cc1C)[C@@H]1C[C@H]1N |
|
| MolPort-027-845-300 |
0.70 |
Cl.COC(C(C)N)c1ccc(Br)cc1 |
|
| MolPort-046-659-043 |
0.70 |
C[C@H](CN)c1ccc(cc1)C1CCC1 |
|
| MolPort-027-674-812 |
0.70 |
Cl.COc1ccc(cc1)C(O)C(C)N |
|
| MolPort-035-777-932 |
0.70 |
CCC(O)(CC)c1cccc(c1)C(C)C |
|
| MolPort-025-494-892 |
0.70 |
CCc1cccc(c1)C(O)(CC)CC |
|
| MolPort-046-656-733 |
0.70 |
C[C@@H](CN)c1ccc(cc1)C1CCC1 |
|
| MolPort-029-945-099 |
0.70 |
NC(=O)[C@@H](O)c1ccccc1 |
|
| MolPort-035-779-508 |
0.70 |
CCC(O)(CC)c1cccc(c1)C(C)(C)C |
|
| MolPort-035-780-973 |
0.70 |
CCCCc1ccc(cc1)C(C)(O)CC |
|
| MolPort-023-313-447 |
0.70 |
OC1(CCC1)c1ccccc1 |
|
| MolPort-035-780-406 |
0.70 |
CCCCc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-046-761-819 |
0.70 |
C[C@@H](N)[C@H](O)c1ccc(O)c(O)c1 |
|
| MolPort-020-167-044 |
0.70 |
Cl.COC(C(C)N)c1ccc(Cl)cc1 |
|
| MolPort-044-546-009 |
0.70 |
CCC(OC)c1ccc2ccccc2c1 |
|
| MolPort-029-527-590 |
0.70 |
Cc1cccc(c1C)C1(CN)CC1 |
|
| MolPort-023-047-584 |
0.70 |
COC(CN)(OC)c1ccccc1 |
|
| MolPort-046-656-733 |
0.70 |
C[C@@H](CN)c1ccc(cc1)C1CCC1 |
|
| MolPort-014-879-210 |
0.70 |
CC(C)C(C)(O)c1ccc(C)c(C)c1 |
|
| MolPort-002-043-206 |
0.70 |
CC(C)(C(O)c1ccccc1)[N+]([O-])=O |
|
| MolPort-008-604-764 |
0.70 |
CCCCc1ccc(cc1)C(O)CC |
|
| MolPort-035-780-973 |
0.70 |
CCCCc1ccc(cc1)C(C)(O)CC |
|
| MolPort-027-845-300 |
0.70 |
Cl.COC(C(C)N)c1ccc(Br)cc1 |
|
| MolPort-035-780-505 |
0.70 |
CCCCc1ccc(cc1)C(O)(CC)CC |
|
| MolPort-046-761-819 |
0.70 |
C[C@@H](N)[C@H](O)c1ccc(O)c(O)c1 |
|
| MolPort-003-910-706 |
0.70 |
CC(O)(C1CC1)c1ccccc1 |
|
| MolPort-001-787-184 |
0.70 |
OC(Cc1ccccc1)c1ccccc1 |
|
| MolPort-003-936-470 |
0.70 |
C[C@H]([C@@H](O)c1ccccc1)N1CCCC1 |
|
| MolPort-023-313-736 |
0.70 |
NCC1(CC1)C(O)c1ccccc1 |
|
| MolPort-003-733-080 |
0.70 |
CNC(C)Cc1ccc(C)cc1 |
|
| MolPort-003-936-362 |
0.70 |
C[C@@H]([C@H](O)c1ccccc1)N1CCCC1 |
|
| MolPort-035-780-406 |
0.70 |
CCCCc1ccc(cc1)C(C)(O)C(C)C |
|
| MolPort-025-494-892 |
0.70 |
CCc1cccc(c1)C(O)(CC)CC |
|
| MolPort-011-910-900 |
0.70 |
CCC(O)(CC)c1ccccc1C |
|
| MolPort-002-051-572 |
0.70 |
CCCC(C)(O)c1cccc2ccccc12 |
|
| MolPort-003-666-219 |
0.70 |
C[C@H](N)[C@H](O)c1ccc(O)c(O)c1 |
|
| MolPort-014-879-209 |
0.70 |
CCC(C)(O)c1ccc(C)c(C)c1 |
|
| MolPort-035-765-237 |
0.70 |
Cl.Cc1ccc(cc1C)[C@@H]1C[C@H]1N |
|
| MolPort-011-114-554 |
0.70 |
Cc1ccc(cc1C)C1(CN)CCC1 |
|
| MolPort-009-766-458 |
0.70 |
COP([O-])(=S)OC.C[NH2+][C@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-023-313-447 |
0.70 |
OC1(CCC1)c1ccccc1 |
|
| MolPort-044-546-009 |
0.70 |
CCC(OC)c1ccc2ccccc2c1 |
|
| MolPort-002-051-554 |
0.70 |
CCCC(O)c1cccc2ccccc12 |
|
| MolPort-011-284-768 |
0.70 |
CC(C(O)c1ccccc1)N1CCCC1 |
|
| MolPort-001-792-980 |
0.70 |
OC(C1CC1)c1ccccc1 |
|
| MolPort-046-659-043 |
0.70 |
C[C@H](CN)c1ccc(cc1)C1CCC1 |
|
| MolPort-027-674-812 |
0.70 |
Cl.COc1ccc(cc1)C(O)C(C)N |
|
| MolPort-002-051-556 |
0.70 |
CCCC(O)c1ccc2ccccc2c1 |
|
| MolPort-035-777-932 |
0.70 |
CCC(O)(CC)c1cccc(c1)C(C)C |
|
| MolPort-002-051-571 |
0.70 |
CCCC(C)(O)c1ccc2ccccc2c1 |
|
| MolPort-008-545-726 |
0.70 |
CCC(O)c1ccc(C)c(C)c1 |
|
| MolPort-003-733-817 |
0.70 |
Cc1ccc(CC(N)Cc2ccc(C)cc2)cc1 |
|
| MolPort-020-167-044 |
0.70 |
Cl.COC(C(C)N)c1ccc(Cl)cc1 |
|
| MolPort-035-779-508 |
0.70 |
CCC(O)(CC)c1cccc(c1)C(C)(C)C |
|
| MCULE-4717924797 |
0.70 |
C1(O)C(C[C@H](C(=C)C)CCC(O)(C)C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(OC)C=1 |
|
| MCULE-3559522784 |
0.70 |
C12=CC(C)=CC=C1OC(CC2=O)C1C=CC(=CC=1)Br |
|
| MCULE-7167906156 |
0.70 |
C12OC(C)(C)CC(=O)C1=CC(C(C)(C)C)=C(O)C=2O |
|
| MCULE-9557247198 |
0.70 |
C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@H](OC)C2=CC=1 |
|
| MCULE-1335950835 |
0.70 |
C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(O)=O |
|
| MCULE-6672284700 |
0.70 |
C1(O)C(C)=C2OC[C@@H](CC3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1C |
|
| MCULE-8632464766 |
0.70 |
[C@H]1(C2=CC=C3OC(C4=CC=CC=C4)(C4=CC=CC=C4)OC3=C2)OC2=CC(O)=CC(O)=C2C[C@@H]1O |
|
| MCULE-7526645898 |
0.70 |
C1(CC(C2C=C(OC)C=CC=2O1)=O)C1C=CC=C(OC)C=1OC |
|
| MCULE-4867351823 |
0.70 |
C12=CC=C(C=C1OCCC2=O)OCC1C=CC=CC=1 |
|
| MCULE-2373585148 |
0.70 |
CC1C(O)=C(C)C2OCC(CC3C=CC(OC)=CC=3)C(=O)C=2C=1O |
|
| MCULE-3666139069 |
0.70 |
C12=CC(OCCOC3=CC=C4C(OC(CC4=O)(C)C)=C3)=CC=C1C(CC(C)(C)O2)=O |
|
| MCULE-5817407631 |
0.70 |
C1(O)C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-6303182626 |
0.70 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(F)=CC=1 |
|
| MCULE-7026035805 |
0.70 |
C1(OC)C(O)=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-1800883309 |
0.70 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-2154315081 |
0.70 |
C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MCULE-7688686969 |
0.70 |
C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](OC)C2=CC=1 |
|
| MCULE-3429694341 |
0.70 |
O1C(C2=CC=C(C=C2)N(=O)=O)C(O)C(C2=CC=C(Br)C=C12)=O |
|
| MolPort-000-942-199 |
0.69 |
CC(NCC#C)C(O)c1ccccc1 |
|
| MolPort-002-510-810 |
0.69 |
C[C@@H]([C@@H](O)c1ccccc1)N(C)N=O |
|
| MolPort-022-384-366 |
0.69 |
CN(C)C(CO)C(O)c1ccc(N)cc1 |
|
| MolPort-044-724-515 |
0.69 |
CC(C)(C(O)c1ccc2ccccc2c1)[N+]([O-])=O |
|
| MolPort-020-114-286 |
0.69 |
Cl.CCC(N)C(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-008-645-185 |
0.69 |
CC1CC(O)(CN)c2ccccc12 |
|
| MolPort-046-417-389 |
0.69 |
C.N[C@@H]1C[C@H]1c1ccccc1 |
|
| MolPort-020-166-881 |
0.69 |
Cl.CC(C)(C)C(N)Cc1ccccc1 |
|
| MolPort-046-690-788 |
0.69 |
[2H]c1c([2H])c([2H])c(C[C@H](N)C(O)=O)c([2H])c1[2H] |
|
| MolPort-027-845-098 |
0.69 |
Cl.COC(C(C)N)c1ccc(F)cc1 |
|
| MolPort-044-724-515 |
0.69 |
CC(C)(C(O)c1ccc2ccccc2c1)[N+]([O-])=O |
|
| MolPort-020-114-286 |
0.69 |
Cl.CCC(N)C(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-022-384-366 |
0.69 |
CN(C)C(CO)C(O)c1ccc(N)cc1 |
|
| MolPort-046-654-818 |
0.69 |
C[C@H](CN)c1ccc2CCCc2c1 |
|
| MolPort-046-692-013 |
0.69 |
[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])[C@H](N)C(O)=O |
|
| MolPort-028-751-485 |
0.69 |
N[C@@H](Cc1ccccc1)C(O)=N |
|
| MolPort-046-690-787 |
0.69 |
N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O |
|
| MolPort-039-339-971 |
0.69 |
OC(=O)C(O)=O.NCCC(O)c1ccccc1 |
|
| MolPort-046-661-278 |
0.69 |
C[C@@H](CN)c1ccc2CCCc2c1 |
|
| MolPort-046-156-594 |
0.69 |
Cl.NC1CC(O)(C1)c1ccccc1 |
|
| MolPort-046-661-703 |
0.69 |
C[C@@H](CN)Cc1cccc(C)c1 |
|
| MolPort-023-198-655 |
0.69 |
Cl.CCC(N)C(C)c1ccccc1 |
|
| MolPort-046-654-826 |
0.69 |
C[C@H](CN)Cc1cccc(C)c1 |
|
| MolPort-046-651-341 |
0.69 |
C[C@@H](N)C(C)c1ccccc1C |
|
| MolPort-046-652-611 |
0.69 |
C[C@H](N)C(C)c1ccccc1C |
|
| MolPort-020-247-994 |
0.69 |
CC1(CC1N)c1ccccc1 |
|
| MolPort-046-662-498 |
0.69 |
C[C@H](CN)Cc1cc(C)cc(C)c1 |
|
| MolPort-004-814-162 |
0.69 |
NCC1(O)CCc2ccccc12 |
|
| MolPort-046-652-257 |
0.69 |
C[C@@H](CN)Cc1cc(C)cc(C)c1 |
|
| MolPort-044-198-216 |
0.69 |
Cl.CC(C)C(C)(N)Cc1ccccc1 |
|
| MolPort-035-683-271 |
0.69 |
Cl.CC[C@H](N)Cc1ccccc1 |
|
| MolPort-027-845-098 |
0.69 |
Cl.COC(C(C)N)c1ccc(F)cc1 |
|
| MolPort-002-507-410 |
0.69 |
CN(C)[C@@H](CO)[C@@H](O)c1ccc(N)cc1 |
|
| MolPort-002-568-428 |
0.69 |
CCCC(O)(C(N)=O)c1ccccc1 |
|
| MolPort-006-395-699 |
0.69 |
NC[C@@H](N)Cc1ccccc1 |
|
| MCULE-2163764809 |
0.69 |
C1(C)(C2C=CC(=CC=2)Cl)CC(=O)C2C(=CC=C(O)C=2)O1 |
|
| MolPort-035-683-271 |
0.69 |
Cl.CC[C@H](N)Cc1ccccc1 |
|
| MCULE-8240919679 |
0.69 |
C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=CC=1 |
|
| MolPort-023-198-655 |
0.69 |
Cl.CCC(N)C(C)c1ccccc1 |
|
| MCULE-5974617735 |
0.69 |
C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3OC)CC(=O)C2=C(O)C=1 |
|
| MolPort-002-029-700 |
0.69 |
NC1(Cc2ccccc2)CC1 |
|
| MCULE-3458953916 |
0.69 |
O1C2C=CC=CC=2C[C@@H](O)[C@@H]1C1C=CC=CC=1 |
|
| MolPort-006-167-624 |
0.69 |
N[C@@H]1CC1c1ccccc1 |
|
| MCULE-8968944056 |
0.69 |
C1(O)C(=C2OC(C3C=CC(O)=CC=3)CC(C2=C(O)C=1C1C(O)C(O)C(O)C(CO)O1)=O)C1C(O)C(O)C(O)C(CO)O1 |
|
| MolPort-008-545-500 |
0.69 |
NC1CC1c1ccccc1 |
|
| MCULE-4553065305 |
0.69 |
C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O |
|
| MolPort-046-652-257 |
0.69 |
C[C@@H](CN)Cc1cc(C)cc(C)c1 |
|
| MCULE-3149822701 |
0.69 |
C1(OC(=O)C)C=C2O[C@H](C3C(OC(=O)C)=CC=CC=3OC(=O)C)CC(=O)C2=C(OC(=O)C)C=1 |
|
| MolPort-020-166-881 |
0.69 |
Cl.CC(C)(C)C(N)Cc1ccccc1 |
|
| MCULE-7943994885 |
0.69 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1 |
|
| MolPort-002-501-507 |
0.69 |
C[C@@H](N)C(c1ccccc1)c1ccccc1 |
|
| MCULE-8135607815 |
0.69 |
CC1(OC2=C(C=CC(=C2)OCC2=CC=C(C(N)=O)C=C2)C(=O)C1)C |
|
| MolPort-002-551-002 |
0.69 |
N[C@H]1C[C@@H]1c1ccccc1 |
|
| MCULE-1252928951 |
0.69 |
Cl.C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O |
|
| MolPort-002-499-673 |
0.69 |
Cl.C[C@H]([C@@H](O)c1ccccc1)N1CCCC1 |
|
| MCULE-6745304759 |
0.69 |
C1C(O)=C2C(C(COC2=CC=1O)CC1C=CC(=CC=1)OC)=O |
|
| MolPort-003-187-106 |
0.69 |
CC(O)c1ccc(CCc2ccc(cc2)C(C)O)cc1 |
|
| MCULE-8407686947 |
0.69 |
C12OC(C)(C)CC(=O)C1=CC=C(OC)C=2O |
|
| MolPort-020-247-994 |
0.69 |
CC1(CC1N)c1ccccc1 |
|
| MCULE-8872050190 |
0.69 |
C12OC(C)(C)C=CC1=C1OC(C3C=CC(O)=CC=3)C(O)C(=O)C1=C(O)C=2 |
|
| MolPort-004-296-486 |
0.69 |
CC(N)C(c1ccccc1)c1ccccc1 |
|
| MCULE-8969680562 |
0.69 |
O1C2=CC(=CC=C2C(C2C(=C(C(CCCCCCCCCCC)=O)C(=C(C(CCCCCCCCCCC)=O)C=2O)O)O)CC1C1=CC=C(C=C1)O)O |
|
| MolPort-044-198-216 |
0.69 |
Cl.CC(C)C(C)(N)Cc1ccccc1 |
|
| MCULE-8487893667 |
0.69 |
C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](O)C2=CC=1 |
|
| MolPort-003-733-062 |
0.69 |
CC(N)Cc1ccccc1C |
|
| MCULE-3425990668 |
0.69 |
C1(C)(C2C=CC(=CC=2)F)CC(=O)C2C(=CC=C(O)C=2)O1 |
|
| MolPort-046-661-703 |
0.69 |
C[C@@H](CN)Cc1cccc(C)c1 |
|
| MCULE-9527875629 |
0.69 |
C1=C(O)C2=C(O[C@@H]([C@H](C2=O)O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)C2=CC=C(O)C=C2)C=C1O |
|
| MolPort-046-662-498 |
0.69 |
C[C@H](CN)Cc1cc(C)cc(C)c1 |
|
| MCULE-1088177999 |
0.69 |
C12OC(CC(=O)C=1C=CC(OCC1C=CC=CC=1F)=C2C)(C)C |
|
| MolPort-046-417-389 |
0.69 |
C.N[C@@H]1C[C@H]1c1ccccc1 |
|
| MCULE-9361233668 |
0.69 |
C12OC(CC(=O)C=1C=CC(OCC1=CC=CC(F)=C1)=C2)(C)C |
|
| MolPort-003-849-906 |
0.69 |
NCC(N)Cc1ccccc1 |
|
| MCULE-2962679821 |
0.69 |
OC1C2C(=O)CC(OC=2C=C(O)C=1C(=O)C)(C)C |
|
| MolPort-046-654-826 |
0.69 |
C[C@H](CN)Cc1cccc(C)c1 |
|
| MCULE-4558837172 |
0.69 |
C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/CC/C=C(\C)/C |
|
| MolPort-013-996-051 |
0.69 |
CC(C(N)CN)c1ccccc1 |
|
| MCULE-6924983703 |
0.69 |
C12C(=O)C[C@H](OC=1C(=C(OC)C(C/C=C(\C)/C)=C2OC)C/C=C(\C)/C)C1C(OC)=CC(=CC=1OC)OC |
|
| MolPort-046-651-341 |
0.69 |
C[C@@H](N)C(C)c1ccccc1C |
|
| MCULE-6592133711 |
0.69 |
CC1C(O)C(O)C(O)C(OC2C(=O)C3C(=CC(=CC=3O)O)OC2C2C=CC(O)=CC=2)O1 |
|
| MolPort-046-652-611 |
0.69 |
C[C@H](N)C(C)c1ccccc1C |
|
| MCULE-1477744891 |
0.69 |
C12C=CC(OCC3C=CC=CC=3F)=CC=1OC(CC2=O)(C)C |
|
| MolPort-003-733-102 |
0.69 |
Cc1cccc(CCCN)c1 |
|
| MCULE-1941541843 |
0.69 |
C12C=C(O)C=CC=1C(CC(C)(C)O2)=O |
|
| MolPort-002-499-715 |
0.69 |
C[C@H](N)C(c1ccccc1)c1ccccc1 |
|
| MCULE-4778304263 |
0.69 |
C12=C(O)C(O)=CC([C@@H]3[C@H](OC(=O)C4C=C(O)C(=C(O)C=4)O)CC4C(=CC(O)=CC=4O3)O)=C1C=C(C=C(O)C2=O)[C@@H]1[C@H](OC(=O)C2C=C(O)C(O)=C(O)C=2)CC2C(=CC(O)=CC=2O1)O |
|
| MolPort-000-876-411 |
0.69 |
NC(Cc1ccccc1)Cc1ccccc1 |
|
| MCULE-4396859889 |
0.69 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC(Br)=CC=1 |
|
| MolPort-002-741-130 |
0.69 |
CC(Cc1ccccc1)N(C)C |
|
| MCULE-1219453843 |
0.69 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)O |
|
| MolPort-001-783-425 |
0.69 |
N[C@@H]1C[C@H]1c1ccccc1 |
|
| MCULE-2408391183 |
0.69 |
C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1C=CC2=C(OCCCO2)C=1 |
|
| MolPort-046-654-818 |
0.69 |
C[C@H](CN)c1ccc2CCCc2c1 |
|
| MCULE-6029890850 |
0.69 |
O[C@H]1[C@@H](C2C3C=C([C@@H]4[C@H](OC(C5=CC(O)=C(O)C(O)=C5)=O)CC5C(=CC(=CC=5O)O)O4)C=C(C(=O)C=3C(O)=C(O)C=2)O)OC2=CC(=CC(O)=C2C1)O |
|
| MolPort-006-395-698 |
0.69 |
NC[C@H](N)Cc1ccccc1 |
|
| MCULE-6856311194 |
0.69 |
C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(OC)C=1 |
|
| MolPort-039-339-971 |
0.69 |
OC(=O)C(O)=O.NCCC(O)c1ccccc1 |
|
| MCULE-1778800371 |
0.69 |
[C@@H]1(OC2=C(C(O)=CC(O)=C2)C(=O)[C@]1([H])O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)C1=CC=C(O)C=C1 |
|
| MolPort-001-757-101 |
0.69 |
N[C@@H](Cc1ccccc1)C(O)=O |
|
| MCULE-3016034856 |
0.69 |
C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC1C=CC=CC=1Cl |
|
| MolPort-000-000-499 |
0.69 |
CC([C@H](N)C(O)=O)c1ccccc1 |
|
| MolPort-003-934-837 |
0.69 |
[15NH2][C@@H](Cc1ccccc1)C(O)=O |
|
| MolPort-003-933-987 |
0.69 |
Cl.N[C@@H](CO)Cc1ccc(O)cc1 |
|
| MolPort-003-933-984 |
0.69 |
Cl.N[C@H](CO)Cc1ccc(O)cc1 |
|
| MolPort-000-001-116 |
0.69 |
C[C@](N)(Cc1ccccc1)C(O)=O |
|
| MolPort-001-780-018 |
0.69 |
NC(Cc1ccccc1)C(O)=O |
|
| MolPort-000-001-115 |
0.69 |
C[C@@](N)(Cc1ccccc1)C(O)=O |
|
| MolPort-046-156-594 |
0.69 |
Cl.NC1CC(O)(C1)c1ccccc1 |
|
| MolPort-008-647-198 |
0.69 |
CC1(C)CC(O)(CN)c2ccccc12 |
|
| MolPort-002-583-884 |
0.69 |
C[N+](C)(C)CCC(O)c1ccccc1 |
|
| MolPort-001-823-897 |
0.69 |
CN(C)CCC(O)c1ccccc1 |
|
| MolPort-028-751-485 |
0.69 |
N[C@@H](Cc1ccccc1)C(O)=N |
|
| MolPort-009-680-906 |
0.69 |
CC(C(N)C(O)=O)c1ccccc1 |
|
| MolPort-001-793-024 |
0.69 |
CC(N)(Cc1ccccc1)C(O)=O |
|
| MolPort-046-692-013 |
0.69 |
[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])[C@H](N)C(O)=O |
|
| MolPort-046-661-278 |
0.69 |
C[C@@H](CN)c1ccc2CCCc2c1 |
|
| MolPort-046-690-788 |
0.69 |
[2H]c1c([2H])c([2H])c(C[C@H](N)C(O)=O)c([2H])c1[2H] |
|
| MolPort-046-690-787 |
0.69 |
N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O |
|
| MolPort-001-757-416 |
0.69 |
N[C@H](Cc1ccccc1)C(O)=O |
|
| MolPort-001-757-270 |
0.69 |
CNCCC(O)c1ccccc1 |
|
| MolPort-035-778-745 |
0.68 |
CCCC(C)(O)c1ccc(CC(C)C)cc1 |
|
| MolPort-003-928-646 |
0.68 |
O[C@H]([C@@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-008-644-296 |
0.68 |
CCCC(O)c1cccc(C)c1 |
|
| MolPort-022-291-417 |
0.68 |
NC[C@H](O)Cc1ccccc1 |
|
| MolPort-003-663-504 |
0.68 |
O[C@@H]([C@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-001-783-502 |
0.68 |
CC(O)(C(O)c1ccccc1)c1ccccc1 |
|
| MolPort-014-879-276 |
0.68 |
CCC(C)(O)c1cc(C)ccc1C |
|
| MolPort-008-604-528 |
0.68 |
CCC(O)c1ccc(C)cc1C |
|
| MolPort-008-546-649 |
0.68 |
CCCC(O)c1ccc(cc1)C(C)C |
|
| MolPort-008-644-367 |
0.68 |
CC(C(O)CN)c1ccccc1 |
|
| MolPort-025-494-880 |
0.68 |
CCCC(C)(O)c1cc(C)cc(C)c1 |
|
| MolPort-022-915-550 |
0.68 |
CC(C)Cc1ccc(cc1)C(O)CO |
|
| MolPort-012-949-207 |
0.68 |
CCC(O)(CC)c1ccc(C)c(C)c1 |
|
| MolPort-019-706-983 |
0.68 |
CC[NH2+]CC(C)(O)c1ccccc1 |
|
| MolPort-003-749-148 |
0.68 |
CC(O)(CN)c1ccc(Br)cc1 |
|
| MolPort-008-604-062 |
0.68 |
CC(O)(CN)c1ccc(cc1)-c1ccccc1 |
|
| MolPort-009-758-586 |
0.68 |
Cl.NC[C@H](O)c1ccc(O)cc1 |
|
| MolPort-004-289-293 |
0.68 |
NCC(O)c1ccccc1O |
|
| MolPort-001-758-385 |
0.68 |
NCC(O)c1ccc(Br)cc1 |
|
| MolPort-001-793-589 |
0.68 |
CC(C)NCC(O)c1ccccc1 |
|
| MolPort-046-690-683 |
0.68 |
Cl.[2H]C([2H])(N)C([2H])(O)c1ccc(O)cc1 |
|
| MolPort-011-893-315 |
0.68 |
CCCC(C)(O)c1cccc(C)c1 |
|
| MolPort-044-874-152 |
0.68 |
Cl.CC(C)Cc1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-029-938-985 |
0.68 |
Cl.Cc1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-013-943-882 |
0.68 |
Cc1cc(C)cc(CCN)c1 |
|
| MolPort-046-666-716 |
0.68 |
C[C@H](CN)c1cc(C)cc(C)c1 |
|
| MolPort-008-512-867 |
0.68 |
Cc1cccc(c1)C(C)(C)CN |
|
| MolPort-044-766-014 |
0.68 |
C[C@@H](CN)c1cccc(C)c1 |
|
| MolPort-029-997-387 |
0.68 |
Cl.NC(=N)C(O)c1ccccc1 |
|
| MolPort-011-631-236 |
0.68 |
NCC(O)(c1ccccc1)C(F)(F)F |
|
| MolPort-028-767-006 |
0.68 |
Cl.CC(O)(C(N)=N)c1ccccc1 |
|
| MolPort-000-826-737 |
0.68 |
Cl.NCC(O)c1ccc(O)cc1 |
|
| MolPort-002-510-033 |
0.68 |
CC(C)NC[C@](C)(O)c1ccccc1 |
|
| MolPort-014-788-776 |
0.68 |
CC(O)(C1CC1)c1ccc2ccccc2c1 |
|
| MolPort-035-779-902 |
0.68 |
CCC(C)(O)c1c(C)cc(C)cc1C |
|
| MolPort-016-584-410 |
0.68 |
CC(C)(O)C(C)(C)C(O)c1ccccc1 |
|
| MolPort-014-793-936 |
0.68 |
CC(C)C(C)(O)c1ccc(C)cc1C |
|
| MolPort-027-949-106 |
0.68 |
NC[C@@H](O)Cc1ccccc1 |
|
| MolPort-035-779-475 |
0.68 |
CC(C)C(C)(O)c1c(C)cc(C)cc1C |
|
| MolPort-014-793-934 |
0.68 |
CCC(C)(O)c1ccc(C)cc1C |
|
| MolPort-008-644-313 |
0.68 |
CCC(O)c1cccc(C)c1C |
|
| MolPort-035-781-189 |
0.68 |
CCCCc1ccc(cc1)C(C)(O)CCC |
|
| MolPort-000-000-780 |
0.68 |
NCC(O)Cc1ccccc1 |
|
| MolPort-039-314-058 |
0.68 |
Cl.Cc1ccc(cc1)[C@@H]1C[C@H]1N |
|
| MolPort-004-947-174 |
0.68 |
Cl.Cc1ccc(CC2(N)CC2)cc1 |
|
| MolPort-014-879-128 |
0.68 |
CCCC(C)(O)c1ccc(CC)cc1 |
|
| MolPort-046-790-997 |
0.68 |
Cl.CC(C)c1ccc(cc1)C1(O)CNC1 |
|
| MolPort-029-997-713 |
0.68 |
O.Cl.NC1(Cc2ccccc2)CC1 |
|
| MolPort-025-494-835 |
0.68 |
CCCC(C)(O)c1ccc(cc1)C(C)C |
|
| MolPort-035-781-189 |
0.68 |
CCCCc1ccc(cc1)C(C)(O)CCC |
|
| MolPort-027-143-059 |
0.68 |
CCC(O)c1ccc(COC)cc1 |
|
| MolPort-035-779-475 |
0.68 |
CC(C)C(C)(O)c1c(C)cc(C)cc1C |
|
| MolPort-025-494-880 |
0.68 |
CCCC(C)(O)c1cc(C)cc(C)c1 |
|
| MolPort-022-915-550 |
0.68 |
CC(C)Cc1ccc(cc1)C(O)CO |
|
| MolPort-023-282-783 |
0.68 |
Cl.CNC(C)(C)Cc1ccc(C)cc1 |
|
| MolPort-022-291-417 |
0.68 |
NC[C@H](O)Cc1ccccc1 |
|
| MolPort-035-778-745 |
0.68 |
CCCC(C)(O)c1ccc(CC(C)C)cc1 |
|
| MolPort-025-494-874 |
0.68 |
CCCC(C)(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-027-835-743 |
0.68 |
O[C@@H]([C@@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-035-765-356 |
0.68 |
Cl.CC(C)c1ccc(cc1)[C@@H]1C[C@H]1N |
|
| MolPort-046-790-997 |
0.68 |
Cl.CC(C)c1ccc(cc1)C1(O)CNC1 |
|
| MolPort-028-767-006 |
0.68 |
Cl.CC(O)(C(N)=N)c1ccccc1 |
|
| MolPort-029-997-387 |
0.68 |
Cl.NC(=N)C(O)c1ccccc1 |
|
| MolPort-046-690-683 |
0.68 |
Cl.[2H]C([2H])(N)C([2H])(O)c1ccc(O)cc1 |
|
| MolPort-029-938-985 |
0.68 |
Cl.Cc1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-044-874-152 |
0.68 |
Cl.CC(C)Cc1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-044-766-014 |
0.68 |
C[C@@H](CN)c1cccc(C)c1 |
|
| MolPort-046-666-716 |
0.68 |
C[C@H](CN)c1cc(C)cc(C)c1 |
|
| MolPort-046-651-636 |
0.68 |
C[C@@H](CN)c1cc(C)cc(C)c1 |
|
| MolPort-046-666-714 |
0.68 |
C[C@H](CN)c1cccc(C)c1 |
|
| MolPort-023-048-148 |
0.68 |
CCCCc1ccc(cc1)C(C)(C)O |
|
| MolPort-039-240-891 |
0.68 |
Cl.CC(C)(c1ccccc1)C1(N)CC1 |
|
| MolPort-046-688-145 |
0.68 |
Cl.CC(c1ccccc1)C1(N)CC1 |
|
| MolPort-039-137-310 |
0.68 |
Cl.N[C@@H]1C[C@@H]1c1ccccc1 |
|
| MolPort-029-996-105 |
0.68 |
Cl.N[C@H]1CC1c1ccccc1 |
|
| MolPort-028-951-233 |
0.68 |
Cl.CNC(C)C(C)c1ccccc1 |
|
| MolPort-035-395-801 |
0.68 |
Cl.N[C@H]1C[C@@H]1c1ccccc1 |
|
| MolPort-035-789-635 |
0.68 |
Cl.Cl.CC(C(N)CN)c1ccccc1 |
|
| MolPort-035-779-902 |
0.68 |
CCC(C)(O)c1c(C)cc(C)cc1C |
|
| MolPort-039-314-058 |
0.68 |
Cl.Cc1ccc(cc1)[C@@H]1C[C@H]1N |
|
| MolPort-020-071-994 |
0.68 |
Cl.CC1(CC1N)c1ccccc1 |
|
| MolPort-027-949-106 |
0.68 |
NC[C@@H](O)Cc1ccccc1 |
|
| MolPort-044-615-178 |
0.68 |
Cl.Cl.Cc1ccc(CC(N)CN)cc1 |
|
| MolPort-042-652-397 |
0.68 |
Cl.N[C@H]1C[C@H]1c1ccccc1 |
|
| MolPort-025-494-834 |
0.68 |
CCCc1ccc(cc1)C(C)(O)CCC |
|
| MCULE-7044126112 |
0.68 |
[C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OS(=O)(=O)C)C1C=CC(OC)=CC=1 |
|
| MCULE-6600418013 |
0.68 |
C1C2C(=CC(O)=CC=2O)OC(C2C=C3C(C4OC5C(=C(O)C=C(O)C=5)CC4OC(C4C=C(O)C(O)=C(O)C=4)=O)=CC(O)=C(O)C3=C(O)C(=O)C=2)C1OC(C1C=C(O)C(O)=C(O)C=1)=O |
|
| MCULE-9893041359 |
0.68 |
OC1C=CC([C@H]2OC3C(=C(C=C(C=3)O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O)C(=O)C2)=CC=1O |
|
| MCULE-4497191154 |
0.68 |
CC1OC(OCC2OC(OC3C=C4C(C(CC(C5C=CC(O)=C(O)C=5)O4)=O)=C(O)C=3)C(O)C(O)C2O)C(O)C(O)C1O |
|
| MCULE-5089786365 |
0.68 |
C12C(OC)=CC(=CC=1OC(C)(C)CC2=O)OC |
|
| MCULE-3547616904 |
0.68 |
C12OC(C)(CC/C=C(/C)\C)CCC1=C1OC(C3C=CC(O)=CC=3O)CC(=O)C1=C(O)C=2 |
|
| MCULE-2306135710 |
0.68 |
C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=C(O)C=1)OC)OC1OC(COC2OC(C)C(C(O)C2O)O)C(C(O)C1O)O |
|
| MCULE-9979782762 |
0.68 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(C4C5O[C@H](C6C=CC(O)=CC=6)CC(=O)C=5C(O)=CC=4O)C=3)CC(=O)C2=C(O)C=1 |
|
| MCULE-1855341000 |
0.68 |
[C@@H]1(O)[C@@H](O)[C@H](C)O[C@@H](OC[C@H]2O[C@@H](OC3C=C(O)C4C(=O)C[C@@H](C5C=CC(O)=C(O)C=5)OC=4C=3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O |
|
| MCULE-3938369351 |
0.68 |
C1(CC(C2C=C(C=CC=2O1)Cl)=O)C1=CC=C(OC)C=C1 |
|
| MCULE-1363046696 |
0.68 |
C12OC(=O)C3(C4C(O)=CC(O)=CC=4OC3C3C=C(O)C(O)=CC=3)C1=C1OC(C3C=C(O)C(O)=CC=3)C(O)CC1=C(O)C=2 |
|
| MCULE-6367958739 |
0.68 |
C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(OC)=O |
|
| MCULE-5345753150 |
0.68 |
C12=CC(OC)=CC=C1OC(CC2=O)C1=CC=C(C=C1)F |
|
| MCULE-4801748188 |
0.68 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1=CC=C(C(O)=C1)OC)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@H]([C@H](O)[C@H]1O)O |
|
| MCULE-8890690085 |
0.68 |
C12C(Cl)=CC(=CC=1C(CC(C1C=CC3=C(OCCO3)C=1)O2)=O)Cl |
|
| MCULE-3360689877 |
0.68 |
C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC(O)=C(O)C=6)[C@H](O)CC5=C(O)C=4)[C@H]([C@@H]3O)C2=C(O)C=1)C1C=CC(O)=C(O)C=1 |
|
| MCULE-5212006601 |
0.68 |
C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3OC)CC(=O)C2=C(OC)C=1 |
|
| MCULE-6401179754 |
0.68 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)OC1OC(COC2OC(C)C(C(O)C2O)O)C(C(O)C1O)O |
|
| MCULE-1736405258 |
0.68 |
C1(OC)C=CC(CC2COC3C=C(O)C=CC=3C2=O)=CC=1 |
|
| MCULE-6010310511 |
0.68 |
C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC(O)=C(O)C=6)[C@@H](O)CC5=C(O)C=4)[C@H]([C@@H]3O)C2=C(O)C=1)C1C=CC(O)=C(O)C=1 |
|
| MolPort-005-312-386 |
0.68 |
Cl.CC(N)C(c1ccccc1)c1ccccc1 |
|
| MCULE-7707382821 |
0.68 |
C12=CC(C)=CC=C1OC(CC2=O)C1C=CC(=CC=1)Cl |
|
| MolPort-003-731-228 |
0.68 |
NCC(Cc1ccccc1)c1ccccc1 |
|
| MCULE-7531338916 |
0.68 |
C12C=C(F)C=CC=1OC(CC2=O)C1=CC=CC(OC(C)C)=C1 |
|
| MolPort-003-849-880 |
0.68 |
Cl.N[C@@H]1C[C@H]1c1ccccc1 |
|
| MCULE-7447091722 |
0.68 |
O=C1C2C(OC)=C(C(=O)C)C(O)=CC=2OC(C)(C)C1 |
|
| MolPort-039-240-891 |
0.68 |
Cl.CC(C)(c1ccccc1)C1(N)CC1 |
|
| MCULE-9560944092 |
0.68 |
O[C@@H]1[C@@H](C2C(O)=CC(O)=C3C[C@H]([C@H](OC=23)C2C=C(O)C(O)=CC=2)O)C2C(=C3[C@@]4([C@@H](O)[C@](OC5C4=C(O)C=C(O)C=5)(C4C=C(O)C(O)=CC=4)OC3=CC=2O)[H])O[C@@H]1C1C=C(O)C(O)=CC=1 |
|
| MolPort-003-849-881 |
0.68 |
Cl.[2H]c1c([2H])c([2H])c([C@@H]2C[C@H]2N)c([2H])c1[2H] |
|
| MCULE-4564815884 |
0.68 |
C12=CC(OCC3C=CC(=CC=3)Cl)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC(=CC=1)Cl |
|
| MolPort-039-137-310 |
0.68 |
Cl.N[C@@H]1C[C@@H]1c1ccccc1 |
|
| MCULE-5060358786 |
0.68 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=1 |
|
| MolPort-016-636-029 |
0.68 |
Cl.Cc1ccccc1CC(C)(C)N |
|
| MCULE-2805260891 |
0.68 |
C12(COC3=C(C=CC=C3)C1=O)C(O2)C1=CC=C(C=C1)C(C)C |
|
| MolPort-029-996-105 |
0.68 |
Cl.N[C@H]1CC1c1ccccc1 |
|
| MCULE-2750758088 |
0.68 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-029-997-713 |
0.68 |
O.Cl.NC1(Cc2ccccc2)CC1 |
|
| MCULE-2924473141 |
0.68 |
C1C(=C2C(=C(C=1O)CC)O[C@H](C)CC2=O)OC |
|
| MolPort-023-048-148 |
0.68 |
CCCCc1ccc(cc1)C(C)(C)O |
|
| MCULE-9278940968 |
0.68 |
C1C(=C2C(=O)C[C@H](OC2=C2CCOC=12)C)OC |
|
| MolPort-028-951-233 |
0.68 |
Cl.CNC(C)C(C)c1ccccc1 |
|
| MCULE-4012809924 |
0.68 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-042-652-397 |
0.68 |
Cl.N[C@H]1C[C@H]1c1ccccc1 |
|
| MCULE-8793789355 |
0.68 |
CC(OCC(COC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)O)C |
|
| MolPort-035-395-801 |
0.68 |
Cl.N[C@H]1C[C@@H]1c1ccccc1 |
|
| MCULE-7588457893 |
0.68 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)N(=O)=O |
|
| MolPort-016-633-988 |
0.68 |
Cl.CC(N)Cc1ccccc1C |
|
| MCULE-9673811637 |
0.68 |
C1(O)C=C2C(=C(C=1)O)C1C(C(C3=CC(=C(O)C=C3)O)(O2)OC2C1=C1OC(C(C(C1=C(O)C=2)C1C(O)=CC(O)=C2CC(O)C(C3C=C(O)C(O)=CC=3)OC=12)O)C1C=C(O)C(O)=CC=1)O |
|
| MolPort-003-791-561 |
0.68 |
Cl.NC(Cc1ccccc1)Cc1ccccc1 |
|
| MCULE-4058220272 |
0.68 |
O([C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O)[C@@H]1[C@H]([C@@H]([C@@H](CO)O[C@H]1OC1C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=C(O)C=1)O)O |
|
| MolPort-035-789-635 |
0.68 |
Cl.Cl.CC(C(N)CN)c1ccccc1 |
|
| MCULE-7514536669 |
0.68 |
O(C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC1C=C2OC(C3C=CC(O)=C(O)C=3)CC(=O)C2=C(O)C=1)O)O)O)[C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O |
|
| MolPort-008-426-211 |
0.68 |
CCCC(CN)c1ccccc1 |
|
| MCULE-8143016945 |
0.68 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OC |
|
| MolPort-046-688-145 |
0.68 |
Cl.CC(c1ccccc1)C1(N)CC1 |
|
| MCULE-7123585792 |
0.68 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(C1C=CC=CC=1)=O |
|
| MolPort-001-794-187 |
0.68 |
CCCCc1ccc(CO)cc1 |
|
| MCULE-3426201479 |
0.68 |
C12C=C(C=CC(=O)C=1C=CC=C2[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1)[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1 |
|
| MolPort-004-290-318 |
0.68 |
CCCCc1ccc(cc1)C(C)O |
|
| MCULE-8275106243 |
0.68 |
C12OC(CC(=O)C=1C=CC(OCC1=CC(=CC(C(F)(F)F)=C1)C(F)(F)F)=C2C)(C)C |
|
| MolPort-020-071-994 |
0.68 |
Cl.CC1(CC1N)c1ccccc1 |
|
| MCULE-9497505068 |
0.68 |
C12OC(C)(C)CC(=O)C1=CC=C(O)C=2C |
|
| MolPort-016-636-595 |
0.68 |
Cl.NC1CC1c1ccccc1 |
|
| MCULE-1196118335 |
0.68 |
C1(O)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=1 |
|
| MolPort-004-947-173 |
0.68 |
Cl.NC1(Cc2ccccc2)CC1 |
|
| MCULE-8154919951 |
0.68 |
C1(OC)C=C2O[C@H](C3C=CC(OC)=C(OC)C=3)CCC2=CC=1 |
|
| MolPort-046-666-714 |
0.68 |
C[C@H](CN)c1cccc(C)c1 |
|
| MolPort-046-651-636 |
0.68 |
C[C@@H](CN)c1cc(C)cc(C)c1 |
|
| MolPort-002-051-560 |
0.68 |
OC(CCc1ccccc1)c1ccccc1 |
|
| MolPort-008-643-833 |
0.68 |
CC(CN)c1cccc(C)c1 |
|
| MolPort-008-545-727 |
0.68 |
CCC(O)c1cc(C)ccc1C |
|
| MolPort-025-494-835 |
0.68 |
CCCC(C)(O)c1ccc(cc1)C(C)C |
|
| MolPort-027-835-743 |
0.68 |
O[C@@H]([C@@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-023-282-783 |
0.68 |
Cl.CNC(C)(C)Cc1ccc(C)cc1 |
|
| MolPort-008-604-768 |
0.68 |
CCCC(O)c1ccc(CCC)cc1 |
|
| MolPort-008-546-080 |
0.68 |
CCCC(O)c1ccc(CC)cc1 |
|
| MolPort-035-765-356 |
0.68 |
Cl.CC(C)c1ccc(cc1)[C@@H]1C[C@H]1N |
|
| MolPort-008-605-102 |
0.68 |
CCCCc1ccc(cc1)C(O)CCC |
|
| MolPort-001-767-552 |
0.68 |
OC(C(O)c1ccccc1)c1ccccc1 |
|
| MolPort-011-893-277 |
0.68 |
CCCC(C)(O)c1ccc(C)cc1 |
|
| MolPort-025-494-874 |
0.68 |
CCCC(C)(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-012-949-459 |
0.68 |
CC(C)C(C)(O)c1cccc(C)c1C |
|
| MolPort-008-645-378 |
0.68 |
CCCC(O)c1cc(C)cc(C)c1 |
|
| MolPort-012-949-457 |
0.68 |
CCC(C)(O)c1cccc(C)c1C |
|
| MolPort-014-788-773 |
0.68 |
CC(O)(C1CC1)c1cccc2ccccc12 |
|
| MolPort-003-910-936 |
0.68 |
CCCC(O)c1ccc(C)cc1 |
|
| MolPort-025-494-834 |
0.68 |
CCCc1ccc(cc1)C(C)(O)CCC |
|
| MolPort-000-157-392 |
0.68 |
Cc1cccc(CCN)c1 |
|
| MolPort-044-615-178 |
0.68 |
Cl.Cl.Cc1ccc(CC(N)CN)cc1 |
|
| MolPort-014-879-277 |
0.68 |
CC(C)C(C)(O)c1cc(C)ccc1C |
|
| MolPort-027-143-059 |
0.68 |
CCC(O)c1ccc(COC)cc1 |
|
| MolPort-008-547-535 |
0.68 |
CCCC(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-008-604-588 |
0.68 |
CCC(O)c1c(C)cc(C)cc1C |
|
| MCULE-9516234846 |
0.67 |
C1(C(O)=O)=C(OC)C(OC)=CC=C1C1CC(=O)C2=C(C=CC=C2)O1 |
|
| MolPort-035-779-406 |
0.67 |
CCc1ccccc1C(C)(O)C(C)C |
|
| MCULE-6997931016 |
0.67 |
C1(O)C(C/C=C(\CC/C=C(\C)/C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1 |
|
| MolPort-016-635-564 |
0.67 |
Cl.NCC(O)(c1ccccc1)C(F)(F)F |
|
| MCULE-3711190397 |
0.67 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(N(=O)=O)=CC=1 |
|
| MolPort-008-512-869 |
0.67 |
CC(C)(C)c1ccc(cc1)C(C)(C)CN |
|
| MCULE-5956278100 |
0.67 |
C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OC |
|
| MolPort-003-749-146 |
0.67 |
CC(O)(CN)c1ccc(F)cc1 |
|
| MCULE-7305711707 |
0.67 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC(=O)O |
|
| MolPort-001-795-047 |
0.67 |
Cc1ccc(C[C@H](N)c2ccccc2)cc1 |
|
| MCULE-6881330938 |
0.67 |
C12C=CC(Cl)=CC=1C(=O)CC(C1=CC=CC=C1)O2 |
|
| MolPort-003-742-175 |
0.67 |
Cc1ccc(CC(CN)CO)cc1 |
|
| MCULE-8753334659 |
0.67 |
C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C |
|
| MolPort-013-711-684 |
0.67 |
COCCC(O)c1ccccc1 |
|
| MCULE-1758109396 |
0.67 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(OC)C=1 |
|
| MolPort-046-153-406 |
0.67 |
NC(CO)Cc1ccccc1I |
|
| MCULE-8169575133 |
0.67 |
C12C(C/C=C(/C)\C)=C(OC(C)=O)C=C(OC(C)=O)C=1C(C[C@@H](C1C=CC=CC=1)O2)=O |
|
| MolPort-016-631-618 |
0.67 |
CC(C)(N)Cc1ccc(O)cc1 |
|
| MCULE-8640003899 |
0.67 |
C12OC(CC(=O)C=1C=CC(OCC1C=CC(Cl)=CC=1Cl)=C2C)(C)C |
|
| MolPort-011-138-763 |
0.67 |
CCCC[C@H](O)c1ccccc1 |
|
| MCULE-5411478435 |
0.67 |
OC1C(=O)C2=C(C=CC=C2)OC1 |
|
| MolPort-035-779-023 |
0.67 |
CC(C)c1ccccc1C(C)(O)C(C)C |
|
| MCULE-5802239646 |
0.67 |
C1(O)C=C2OC(C3C=CC(O)=C(C/C=C(\C)/CC/C=C(\C)/C)C=3O)CC(=O)C2=C(O)C=1 |
|
| MolPort-028-757-251 |
0.67 |
Cl.NCC(O)c1ccc(cc1)-c1ccccc1 |
|
| MCULE-4044377173 |
0.67 |
C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-035-778-372 |
0.67 |
CCC(O)c1ccccc1C(C)C |
|
| MolPort-046-153-196 |
0.67 |
N[C@H](CO)Cc1ccccc1I |
|
| MolPort-008-425-726 |
0.67 |
CC(CN)c1ccc(C)cc1 |
|
| MolPort-020-057-460 |
0.67 |
CN(CC(O)c1ccccc1)C(C)(C)CO |
|
| MolPort-042-682-884 |
0.67 |
N[C@H](CO)Cc1ccc(F)cc1 |
|
| MolPort-000-002-440 |
0.67 |
NC(Cc1ccc(cc1)C(O)=O)C(O)=O |
|
| MolPort-046-196-337 |
0.67 |
C[C@@H]([C@H](O)c1ccccc1)N(C)C(C)=O |
|
| MolPort-006-170-570 |
0.67 |
CN[C@H]([C@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-046-069-262 |
0.67 |
CN[C@@H]([C@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-000-708-790 |
0.67 |
CCCCCN(C)[C@H](C)[C@H](O)c1ccccc1 |
|
| MolPort-046-688-709 |
0.67 |
C[C@H]([C@@H](O)c1ccccc1)N(C)C(C)=O |
|
| MolPort-016-636-460 |
0.67 |
Cl.CC(N)C(O)c1ccc(Cl)cc1Cl |
|
| MolPort-006-665-911 |
0.67 |
N[C@@H](Cc1ccc(cc1)C(O)=O)C(O)=O |
|
| MolPort-002-017-697 |
0.67 |
OC1(CCNC1)c1ccccc1 |
|
| MolPort-014-433-645 |
0.67 |
CC(C)NCC(O)c1ccc2ccccc2c1 |
|
| MolPort-008-645-220 |
0.67 |
CCc1ccc(cc1)C(C)(C)CN |
|
| MolPort-006-712-918 |
0.67 |
NCC(CO)c1ccccc1 |
|
| MolPort-000-752-491 |
0.67 |
[Cl-].CC[NH2+]C[C@@](C)(O)c1ccccc1 |
|
| MolPort-011-138-807 |
0.67 |
CCCC[C@@H](O)c1ccccc1 |
|
| MolPort-000-742-837 |
0.67 |
[Cl-].CC(C)[NH2+]CC(C)(O)c1ccccc1 |
|
| MolPort-003-664-493 |
0.67 |
OC(CC=C)c1ccccc1 |
|
| MolPort-008-491-895 |
0.67 |
CC(CN)c1ccc(cc1)C(C)(C)C |
|
| MolPort-035-781-898 |
0.67 |
CCC(C)(O)c1ccccc1C(C)C |
|
| MolPort-020-671-558 |
0.67 |
CCC(O)c1ccccc1CC |
|
| MolPort-012-946-975 |
0.67 |
CCc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-022-370-269 |
0.67 |
CC(C)(O)C(N)c1ccccc1 |
|
| MolPort-046-147-394 |
0.67 |
Cl.NC[C@@H](O)Cc1ccccc1 |
|
| MolPort-046-668-056 |
0.67 |
C[C@H](CN)c1ccc(cc1)C(C)(C)C |
|
| MolPort-009-765-882 |
0.67 |
Cl.CCNC[C@](C)(O)c1ccccc1 |
|
| MolPort-035-681-814 |
0.67 |
Cl.N[C@H](CO)Cc1ccc(Cl)cc1 |
|
| MolPort-000-157-393 |
0.67 |
Cc1ccc(CCN)cc1 |
|
| MolPort-012-949-059 |
0.67 |
CCC(O)(CC)c1cc(C)ccc1C |
|
| MolPort-014-795-105 |
0.67 |
CC(C)c1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-046-654-814 |
0.67 |
C[C@H](CN)c1ccc(C)c(C)c1 |
|
| MolPort-035-777-883 |
0.67 |
CCc1ccccc1C(C)(O)CC |
|
| MolPort-046-654-814 |
0.67 |
C[C@H](CN)c1ccc(C)c(C)c1 |
|
| MolPort-035-780-457 |
0.67 |
CCC(O)(CC)c1c(C)cc(C)cc1C |
|
| MolPort-014-795-223 |
0.67 |
CCCc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-001-793-996 |
0.67 |
CCCCC(O)c1ccccc1 |
|
| MolPort-001-760-313 |
0.67 |
OC(=O)C(O)=O.Cc1ccccc1C(O)CN |
|
| MolPort-001-760-315 |
0.67 |
Cl.NCC(O)Cc1ccccc1 |
|
| MolPort-003-886-019 |
0.67 |
NCC(O)c1ccccc1Br |
|
| MolPort-046-654-947 |
0.67 |
C[C@@H](CN)c1ccc(cc1)C(C)(C)C |
|
| MolPort-009-757-575 |
0.67 |
Cl.CC(C)NC[C@](C)(O)c1ccccc1 |
|
| MolPort-033-355-997 |
0.67 |
Cl.CCOC(CN)c1ccccc1 |
|
| MolPort-035-778-271 |
0.67 |
CC(C)Cc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-009-682-639 |
0.67 |
NC(CCCO)Cc1ccccc1 |
|
| MolPort-003-910-948 |
0.67 |
Cc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-003-919-799 |
0.67 |
CC(O)(CC=C)c1ccccc1 |
|
| MolPort-012-437-403 |
0.67 |
COC(CN)c1ccccc1C |
|
| MolPort-028-907-853 |
0.67 |
CC(NCC#N)C(C)(C)c1ccccc1 |
|
| MolPort-011-910-904 |
0.67 |
Cc1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-001-778-668 |
0.67 |
Cl.NCC(O)c1ccc(Cl)cc1 |
|
| MolPort-020-006-064 |
0.67 |
CC(=O)[C@@H](O)c1ccccc1 |
|
| MolPort-008-644-219 |
0.67 |
Cc1cccc(c1)C(O)C1CC1 |
|
| MolPort-001-788-078 |
0.67 |
OC(CC#C)c1ccccc1 |
|
| MolPort-046-661-275 |
0.67 |
C[C@@H](CN)c1ccc(C)c(C)c1 |
|
| MolPort-038-942-167 |
0.67 |
CC(C)(O)[C@@H](N)c1ccccc1 |
|
| MolPort-000-154-859 |
0.67 |
Cc1ccc(CCN)cc1C |
|
| MolPort-000-001-175 |
0.67 |
NCC(O)c1ccc(F)cc1 |
|
| MolPort-002-800-300 |
0.67 |
Cc1cc(C)cc(CC(C)(C)C)c1 |
|
| MolPort-012-949-458 |
0.67 |
CCC(O)(CC)c1cccc(C)c1C |
|
| MolPort-002-550-980 |
0.67 |
Cc1ccc(cc1)C(O)C1CC1 |
|
| MolPort-026-526-588 |
0.67 |
CC(C)C(C)(O)c1cc(C)c(C)cc1C |
|
| MolPort-044-175-437 |
0.67 |
OC(CC(O)c1ccccc1)c1ccccc1 |
|
| MolPort-044-181-979 |
0.67 |
OCc1cccc(c1)C12CC(C1)C2 |
|
| MolPort-020-916-317 |
0.67 |
CCC(O)c1cc(C)c(C)cc1C |
|
| MolPort-014-461-245 |
0.67 |
Cc1cc(C)cc(c1)C(C)(O)C1CC1 |
|
| MolPort-044-435-932 |
0.67 |
Cl.NC[C@@]1(C[C@H](O)C1)c1ccccc1 |
|
| MolPort-002-467-084 |
0.67 |
CC(C)c1ccc(CCN)cc1 |
|
| MolPort-006-110-403 |
0.67 |
CC(=O)C(O)c1ccccc1 |
|
| MolPort-022-913-075 |
0.67 |
CC(CN)(CO)c1ccccc1 |
|
| MolPort-022-657-328 |
0.67 |
CC(O)(CN)c1ccccc1Br |
|
| MolPort-014-793-935 |
0.67 |
CCC(O)(CC)c1ccc(C)cc1C |
|
| MolPort-000-001-213 |
0.67 |
NCC(O)c1ccc(Cl)cc1 |
|
| MolPort-000-155-334 |
0.67 |
CCc1ccc(CCN)cc1 |
|
| MolPort-012-949-767 |
0.67 |
CC(C)(C)c1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-038-949-944 |
0.67 |
Cl.NC[C@H](O)c1ccc(Cl)cc1 |
|
| MolPort-002-683-106 |
0.67 |
Cc1ccc(cc1)C(C)(C)CN |
|
| MolPort-038-949-920 |
0.67 |
Cl.NC[C@@H](O)c1ccc(Cl)cc1 |
|
| MolPort-020-116-272 |
0.67 |
Cl.Cc1cccc(CC(N)C2CC2)c1 |
|
| MolPort-000-152-601 |
0.67 |
CC(C)(C)c1ccc(CCN)cc1 |
|
| MolPort-027-836-883 |
0.67 |
Cl.NCC(O)c1ccc(Br)cc1 |
|
| MolPort-046-153-197 |
0.67 |
N[C@@H](CO)Cc1ccccc1I |
|
| MolPort-046-419-956 |
0.67 |
Cl.C[C@@](N)(Cc1ccccc1)C(O)=O |
|
| MolPort-013-040-551 |
0.67 |
CC(CO)NCC(O)c1ccccc1 |
|
| MolPort-044-203-466 |
0.67 |
Cl.CC(N)(CO)Cc1ccc(Cl)cc1 |
|
| MolPort-022-913-075 |
0.67 |
CC(CN)(CO)c1ccccc1 |
|
| MolPort-022-370-269 |
0.67 |
CC(C)(O)C(N)c1ccccc1 |
|
| MolPort-027-836-883 |
0.67 |
Cl.NCC(O)c1ccc(Br)cc1 |
|
| MolPort-035-779-023 |
0.67 |
CC(C)c1ccccc1C(C)(O)C(C)C |
|
| MolPort-046-661-275 |
0.67 |
C[C@@H](CN)c1ccc(C)c(C)c1 |
|
| MolPort-035-779-406 |
0.67 |
CCc1ccccc1C(C)(O)C(C)C |
|
| MolPort-035-780-457 |
0.67 |
CCC(O)(CC)c1c(C)cc(C)cc1C |
|
| MolPort-046-668-056 |
0.67 |
C[C@H](CN)c1ccc(cc1)C(C)(C)C |
|
| MolPort-035-781-898 |
0.67 |
CCC(C)(O)c1ccccc1C(C)C |
|
| MolPort-022-657-328 |
0.67 |
CC(O)(CN)c1ccccc1Br |
|
| MolPort-044-203-187 |
0.67 |
Cl.CC(N)(CO)Cc1ccc(Br)cc1 |
|
| MolPort-033-355-997 |
0.67 |
Cl.CCOC(CN)c1ccccc1 |
|
| MolPort-046-069-262 |
0.67 |
CN[C@@H]([C@H](O)c1ccccc1)c1ccccc1 |
|
| MolPort-046-196-337 |
0.67 |
C[C@@H]([C@H](O)c1ccccc1)N(C)C(C)=O |
|
| MolPort-046-688-709 |
0.67 |
C[C@H]([C@@H](O)c1ccccc1)N(C)C(C)=O |
|
| MolPort-027-836-613 |
0.67 |
N[C@@H](CO)Cc1ccc(F)cc1 |
|
| MolPort-046-773-732 |
0.67 |
N[C@H](Cc1ccc2ccc3cccc4ccc1c2c34)C(O)=O |
|
| MolPort-046-701-978 |
0.67 |
N[C@H](Cc1c2ccccc2cc2ccccc12)C(O)=O |
|
| MolPort-046-773-728 |
0.67 |
N[C@H](Cc1ccc2cc3ccccc3cc2c1)C(O)=O |
|
| MolPort-026-526-588 |
0.67 |
CC(C)C(C)(O)c1cc(C)c(C)cc1C |
|
| MolPort-035-778-372 |
0.67 |
CCC(O)c1ccccc1C(C)C |
|
| MolPort-035-778-271 |
0.67 |
CC(C)Cc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-035-777-883 |
0.67 |
CCc1ccccc1C(C)(O)CC |
|
| MolPort-046-153-196 |
0.67 |
N[C@H](CO)Cc1ccccc1I |
|
| MolPort-020-006-064 |
0.67 |
CC(=O)[C@@H](O)c1ccccc1 |
|
| MolPort-046-654-947 |
0.67 |
C[C@@H](CN)c1ccc(cc1)C(C)(C)C |
|
| MolPort-044-435-932 |
0.67 |
Cl.NC[C@@]1(C[C@H](O)C1)c1ccccc1 |
|
| MolPort-028-907-853 |
0.67 |
CC(NCC#N)C(C)(C)c1ccccc1 |
|
| MolPort-044-181-979 |
0.67 |
OCc1cccc(c1)C12CC(C1)C2 |
|
| MolPort-044-175-437 |
0.67 |
OC(CC(O)c1ccccc1)c1ccccc1 |
|
| MolPort-028-757-251 |
0.67 |
Cl.NCC(O)c1ccc(cc1)-c1ccccc1 |
|
| MolPort-020-116-272 |
0.67 |
Cl.Cc1cccc(CC(N)C2CC2)c1 |
|
| MolPort-046-147-394 |
0.67 |
Cl.NC[C@@H](O)Cc1ccccc1 |
|
| MolPort-020-671-558 |
0.67 |
CCC(O)c1ccccc1CC |
|
| MolPort-020-916-317 |
0.67 |
CCC(O)c1cc(C)c(C)cc1C |
|
| MolPort-038-949-944 |
0.67 |
Cl.NC[C@H](O)c1ccc(Cl)cc1 |
|
| MolPort-038-949-920 |
0.67 |
Cl.NC[C@@H](O)c1ccc(Cl)cc1 |
|
| MolPort-038-942-167 |
0.67 |
CC(C)(O)[C@@H](N)c1ccccc1 |
|
| MolPort-046-153-406 |
0.67 |
NC(CO)Cc1ccccc1I |
|
| MolPort-035-778-256 |
0.67 |
CCCCc1ccc(cc1)C(C)(O)C1CC1 |
|
| MolPort-046-773-727 |
0.67 |
N[C@@H](Cc1ccc2cc3ccccc3cc2c1)C(O)=O |
|
| MolPort-020-057-460 |
0.67 |
CN(CC(O)c1ccccc1)C(C)(C)CO |
|
| MolPort-046-688-135 |
0.67 |
Cl.C[C@@H](N)Cc1ccc2CCCc2c1 |
|
| MolPort-028-959-615 |
0.67 |
Cl.NC(CO)Cc1ccc(Cl)cc1 |
|
| MolPort-000-914-124 |
0.67 |
NC(Cc1cccc2ccccc12)C(O)=O |
|
| MolPort-001-758-758 |
0.67 |
N[C@@H](Cc1ccc2ccccc2c1)C(O)=O |
|
| MolPort-001-758-760 |
0.67 |
N[C@H](Cc1ccc2ccccc2c1)C(O)=O |
|
| MolPort-046-773-728 |
0.67 |
N[C@H](Cc1ccc2cc3ccccc3cc2c1)C(O)=O |
|
| MolPort-001-790-831 |
0.67 |
NC(CO)Cc1ccc(Cl)cc1 |
|
| MolPort-046-701-978 |
0.67 |
N[C@H](Cc1c2ccccc2cc2ccccc12)C(O)=O |
|
| MolPort-000-705-464 |
0.67 |
[I-].C[N+](C)(C)CCC(O)c1ccccc1 |
|
| MolPort-046-773-727 |
0.67 |
N[C@@H](Cc1ccc2cc3ccccc3cc2c1)C(O)=O |
|
| MolPort-046-773-732 |
0.67 |
N[C@H](Cc1ccc2ccc3cccc4ccc1c2c34)C(O)=O |
|
| MolPort-013-972-329 |
0.67 |
NC1(CO)Cc2ccccc2C1 |
|
| MolPort-005-268-800 |
0.67 |
Cc1ccc(cc1C)C(N)Cc1ccccc1 |
|
| MolPort-044-796-898 |
0.67 |
Cl.CC(C)(C(N)C(O)=O)c1ccccc1 |
|
| MolPort-042-682-930 |
0.67 |
N[C@H](CO)Cc1ccc(Cl)cc1 |
|
| MolPort-027-836-613 |
0.67 |
N[C@@H](CO)Cc1ccc(F)cc1 |
|
| MolPort-042-684-468 |
0.67 |
Cl.CC(N)(Cc1ccccc1)C(O)=O |
|
| MCULE-3921944108 |
0.67 |
O=C1C2C(OC)=C(C=O)C(O)=CC=2OC(C)(C)C1 |
|
| MolPort-035-766-867 |
0.67 |
Cl.C[C@H]([C@@H](N)C(O)=O)c1ccccc1 |
|
| MCULE-2193290964 |
0.67 |
C12C(=CC(=CC=1O[C@]([C@@]([H])(O)C2=O)([H])C1=CC=C(C=C1)O)C)OC1OC(CO)C(C(O)C1O)O |
|
| MolPort-003-932-924 |
0.67 |
Cl.N[C@@H](Cc1ccccc1)C(O)=O |
|
| MCULE-9325410253 |
0.67 |
C1(O)C=C2OC(C3C=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/CC/C=C(\C)/C)C=3O)CC(=O)C2=C(O)C=1 |
|
| MolPort-003-801-600 |
0.67 |
NCC(O)c1cccc(O)c1 |
|
| MCULE-4437868251 |
0.67 |
C1(OC2OC(C)C(C(O)C2O)O)C(O)C(O)C(OC1OC1=CC(O)=C2C(OC(CC2=O)C2=CC=C(C(O)=C2)OC)=C1)CO |
|
| MolPort-001-758-756 |
0.67 |
N[C@H](Cc1cccc2ccccc12)C(O)=O |
|
| MCULE-9356107980 |
0.67 |
[C@@H]1(OC2=CC=C(C=C2)C2CC(=O)C3=C(C=C(C=C3)O)O2)O[C@H](CO)[C@H]([C@H](O)[C@H]1O)O |
|
| MolPort-046-773-731 |
0.67 |
N[C@@H](Cc1ccc2ccc3cccc4ccc1c2c34)C(O)=O |
|
| MCULE-1738451204 |
0.67 |
CC(OC1=CC2=C(CC(C(C3C=C(OC(=O)C)C(OC(=O)C)=C(OC(=O)C)C=3)O2)OC(C2=CC(OC(=O)C)=C(OC(=O)C)C(OC(=O)C)=C2)=O)C(OC(=O)C)=C1)=O |
|
| MolPort-046-688-135 |
0.67 |
Cl.C[C@@H](N)Cc1ccc2CCCc2c1 |
|
| MCULE-5857598406 |
0.67 |
C1C(O)=C2C(OC(CC2=O)C2C=C(S(O)(=O)=O)C(O)=CC=2)=CC=1O |
|
| MolPort-027-019-655 |
0.67 |
NC(CO)Cc1ccc(I)cc1 |
|
| MCULE-1718966435 |
0.67 |
CC1(OC2=C(C(=CC=C2)O)C(=O)C1)C |
|
| MolPort-044-203-466 |
0.67 |
Cl.CC(N)(CO)Cc1ccc(Cl)cc1 |
|
| MCULE-1173100593 |
0.67 |
C12C=C(OC)C=CC=1C(CC(C)O2)=O |
|
| MolPort-042-682-884 |
0.67 |
N[C@H](CO)Cc1ccc(F)cc1 |
|
| MCULE-5695960479 |
0.67 |
C12C=C(Br)C(=CC=1OC(C1=CC=CC=C1)CC2=O)C |
|
| MolPort-044-203-187 |
0.67 |
Cl.CC(N)(CO)Cc1ccc(Br)cc1 |
|
| MCULE-1135807734 |
0.67 |
C1C(=O)C2C=CC(O)=CC=2O[C@@H]1C1C=CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC=1 |
|
| MolPort-044-796-898 |
0.67 |
Cl.CC(C)(C(N)C(O)=O)c1ccccc1 |
|
| MCULE-3467826093 |
0.67 |
C12OC(CC(=O)C=1C(OC)=CC(OC)=C2OC)(C)C |
|
| MolPort-028-959-615 |
0.67 |
Cl.NC(CO)Cc1ccc(Cl)cc1 |
|
| MCULE-1848012489 |
0.67 |
C/C(=C\CCC(=C(CC1C(O)=CC(O)=C(C2OC3C(=C(C=C(C=3)O)O)C(=O)C2)C=1)[H])C)/C |
|
| MolPort-042-682-930 |
0.67 |
N[C@H](CO)Cc1ccc(Cl)cc1 |
|
| MCULE-7325867187 |
0.67 |
C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OCC |
|
| MolPort-035-766-867 |
0.67 |
Cl.C[C@H]([C@@H](N)C(O)=O)c1ccccc1 |
|
| MCULE-9154486801 |
0.67 |
C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1=CC=CC=C1 |
|
| MolPort-042-684-468 |
0.67 |
Cl.CC(N)(Cc1ccccc1)C(O)=O |
|
| MCULE-7448502380 |
0.67 |
[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@@H](CC2=O)C2C=CC(=C(O)C=2)OC)C=1)CO |
|
| MolPort-046-419-956 |
0.67 |
Cl.C[C@@](N)(Cc1ccccc1)C(O)=O |
|
| MCULE-7432095266 |
0.67 |
C1(O)C=C2O[C@H](C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=3)CC(=O)C2=CC=1 |
|
| MolPort-035-681-814 |
0.67 |
Cl.N[C@H](CO)Cc1ccc(Cl)cc1 |
|
| MCULE-5357665740 |
0.67 |
C12=CC(OC)=CC=C1C(CC(C)(C)O2)=O |
|
| MolPort-009-683-518 |
0.67 |
Cc1ccc(c(C)c1)C1(CN)CC1 |
|
| MCULE-9912319515 |
0.67 |
C1C=C2C(O[C@]3([H])COC4C=C(OC)C(OC)=CC=4[C@]3(O)C2=O)=CC=1OC |
|
| MolPort-027-019-655 |
0.67 |
NC(CO)Cc1ccc(I)cc1 |
|
| MCULE-5794123076 |
0.67 |
C1(O)C=C2OC(C3C(O)=CC(O)=C(C/C=C(\C)/CC/C=C(\C)/C)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-002-926-950 |
0.67 |
NC(Cc1ccc2ccccc2c1)C(O)=O |
|
| MCULE-9462328387 |
0.67 |
C1(C2OC3C(=C(OC(C)=O)C=C(C=3C/C=C(\C)/C)OC(C)=O)C(=O)C2)=CC=CC=C1 |
|
| MolPort-046-773-731 |
0.67 |
N[C@@H](Cc1ccc2ccc3cccc4ccc1c2c34)C(O)=O |
|
| MCULE-5732404629 |
0.67 |
C12OC(CC(=O)C1=CC=C(OC)C=2C)(C)C |
|
| MolPort-003-927-936 |
0.67 |
Cl.CC(C(N)C(O)=O)c1ccccc1 |
|
| MCULE-2940029331 |
0.67 |
C12C=C(OCCC)C=CC=1C(CC(C)(C)O2)=O |
|
| MolPort-001-758-757 |
0.67 |
N[C@@H](Cc1cccc2ccccc12)C(O)=O |
|
| MCULE-7171321869 |
0.67 |
C12C(O)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C=CC=1C(=O)C[C@@H](C1C=CC(O)=C(O)C=1)O2 |
|
| MolPort-035-778-256 |
0.67 |
CCCCc1ccc(cc1)C(C)(O)C1CC1 |
|
| MCULE-9443831383 |
0.67 |
C1C(O)=C2CC(O)C(C3C=CC(O)=CC=3)OC2=C2C3(OC4C=C(O)C=C(O)C=4C3=O)C(O)(C3C=CC(O)=CC=3)OC=12 |
|
| MolPort-046-153-197 |
0.67 |
N[C@@H](CO)Cc1ccccc1I |
|
| MCULE-5082193272 |
0.67 |
O1C2=C(C)C(=C(C)C(=C2C(C(C1)CC1=CC=C2C(=C1)OCO2)=O)O)O |
|
| MolPort-003-749-147 |
0.67 |
CC(O)(CN)c1ccc(Cl)cc1 |
|
| MCULE-6655623237 |
0.66 |
C12=C(C)C(O)=CC=C1C(C(C(C)(C)O)O2)=O |
|
| MolPort-046-701-799 |
0.66 |
CN[C@@H]1Cc2ccccc2[C@H]1O |
|
| MCULE-4359209086 |
0.66 |
C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CCC2=C(O)C=1C |
|
| MolPort-003-933-680 |
0.66 |
C[C@@H](CN)c1ccccc1 |
|
| MCULE-1920414499 |
0.66 |
C1(C(O)=O)=CC2=C(OC(CC2)(C)C)C(O)=C1O |
|
| MolPort-001-788-492 |
0.66 |
CC(O)c1ccccc1 |
|
| MCULE-9323415780 |
0.66 |
ClC1=CC2=C(C(CC(C3=CC=CC=C3)O2)=O)C=C1 |
|
| MolPort-020-168-377 |
0.66 |
Cl.CCC(N)C(O)c1ccccc1F |
|
| MCULE-1438357759 |
0.66 |
C1(C2=CC=CC=C2F)CC(=O)C2C(=CC=C(OC)C=2)O1 |
|
| MolPort-022-952-313 |
0.66 |
CC(C)NC(C)C(O)c1ccc(Br)cc1 |
|
| MCULE-4853708291 |
0.66 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-035-680-036 |
0.66 |
N[C@H](CF)[C@H](O)c1ccc(I)cc1 |
|
| MCULE-1782797624 |
0.66 |
C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C=O |
|
| MolPort-044-831-716 |
0.66 |
Cl.N[C@@H](CO)Cc1ccc(F)cc1 |
|
| MCULE-8162303332 |
0.66 |
C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1C/C=C(/C)\C |
|
| MolPort-023-135-115 |
0.66 |
Cl.CC(N)C(O)c1ccc(F)c(F)c1 |
|
| MCULE-3743116895 |
0.66 |
C12C=C(C=C(O)C=1C(=O)C[C@@H](C1=CC=C(O)C=C1)O2)O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O |
|
| MolPort-030-267-540 |
0.66 |
CC(C)C(N)C(O)c1cccc(c1)C(F)(F)F |
|
| MCULE-5444072692 |
0.66 |
OC1C2C(=O)CC3(OC=2C=C(O)C=1)CC3 |
|
| MolPort-044-194-931 |
0.66 |
Cl.NC(Cc1ccc2ccccc2c1)C(O)=O |
|
| MCULE-8223070696 |
0.66 |
C1(C2=CC=CC=C2Cl)CC(=O)C2C(=CC=C(C)C=2)O1 |
|
| MolPort-044-203-189 |
0.66 |
Cl.CC(N)(CO)Cc1ccc(F)cc1 |
|
| MCULE-4692826561 |
0.66 |
C1(C(=O)C2C=C(F)C=CC=2OCC2C=CC=CC=2)C(O1)C1=CC=C2C(OCCO2)=C1 |
|
| MolPort-030-005-005 |
0.66 |
Cl.NC(CO)Cc1ccc(F)cc1 |
|
| MCULE-3819041829 |
0.66 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@@H]2O)O)[C@H]([C@H](O)[C@H]1O)O |
|
| MolPort-001-767-834 |
0.66 |
C[C@H](CN)c1ccccc1 |
|
| MCULE-7607710461 |
0.66 |
C1(C=CC(=CC=1O)OCC1C=CC=CC=1)C(=O)C(CC)CO |
|
| MolPort-001-793-461 |
0.66 |
C[C@@H](O)c1ccccc1 |
|
| MCULE-4755477581 |
0.66 |
OCC1C(O)C(O)C(O)C(OC2C=C3C(=CC=2)C(CC(O3)C2=CC=C(O)C=C2)=O)O1 |
|
| MolPort-046-651-650 |
0.66 |
CCc1ccc(cc1)C(C)[C@H](C)CO |
|
| MCULE-4911952817 |
0.66 |
C12OC(C(O)(C)C)CC=1C(O)=C(C(=O)CCC1C=CC=CC=1)C=C2 |
|
| MolPort-003-751-508 |
0.66 |
CC(C)(CN)c1ccccc1 |
|
| MCULE-1203226416 |
0.66 |
C1(O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=C(OC)C=C(O)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-001-769-810 |
0.66 |
CC(CN)c1ccccc1 |
|
| MCULE-8543785028 |
0.66 |
[C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OS(=O)(=O)C)C1=CC=CC=C1 |
|
| MolPort-000-871-498 |
0.66 |
NCCc1ccccc1 |
|
| MCULE-7277320014 |
0.66 |
C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(C)C)OC=12 |
|
| MolPort-001-759-991 |
0.66 |
CC(C)(O)c1ccccc1 |
|
| MCULE-3441155287 |
0.66 |
C12OC(CC(=O)C=1C=CC(OCC(=O)C)=C2C)(C)C |
|
| MolPort-001-793-460 |
0.66 |
C[C@H](O)c1ccccc1 |
|
| MCULE-6883437736 |
0.66 |
C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@H]([C@H](O)[C@H]1O)O |
|
| MolPort-027-896-294 |
0.66 |
CC(C)(C)c1cccc(CCN)c1 |
|
| MCULE-8501275024 |
0.66 |
CC1(OC2=C(C=CC(=C2)OCC(CC(F)(F)F)O)C(=O)C1)C |
|
| MolPort-035-765-395 |
0.66 |
Cl.NC1(CO)Cc2ccccc2C1 |
|
| MCULE-1933775973 |
0.66 |
C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@](O)(CO)CO3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-046-668-828 |
0.66 |
C[C@@H](CO)Cc1ccc(cc1)C(C)(C)C |
|
| MCULE-4541279484 |
0.66 |
C1(C(=C2C([C@@H](CC(C)C)[C@@H](C(C)C)[C@H](C3C(O)=C(C=O)C(O)=C(C=O)C=3O)O2)=C(C=1C=O)O)C=O)O |
|
| MolPort-046-650-353 |
0.66 |
CCc1cccc(c1)[C@H](C)CN |
|
| MCULE-1617162545 |
0.66 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=C(OC(=O)C)C=3)[C@@H](OC(=O)C)CC2=C(OC(=O)C)C=1 |
|
| MolPort-009-681-245 |
0.66 |
CC(C)Cc1ccc(CCCO)cc1 |
|
| MCULE-5470698700 |
0.66 |
C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC)OC1OC(COC2OC(C)C(C(O)C2O)O)C(C(O)C1O)O |
|
| MolPort-046-655-980 |
0.66 |
C[C@H](CO)C(C)c1ccc(C)cc1 |
|
| MCULE-3718545840 |
0.66 |
C12=C(C)C=C(C=C1OC(CC2=O)(C)C)O |
|
| MolPort-046-657-463 |
0.66 |
CCc1ccc(cc1)C(C)C(C)CO |
|
| MCULE-6272004922 |
0.66 |
O(C1C=CC([C@H]2OC3=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=C3C(=O)C2)=CC=1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
|
| MolPort-046-657-464 |
0.66 |
CC(C)c1ccc(cc1)C(C)C(C)CO |
|
| MCULE-8544169534 |
0.66 |
C12=CC(F)=CC=C1OC(CC2=O)C1C=CC=CC=1 |
|
| MolPort-046-657-649 |
0.66 |
CCc1ccc(C[C@H](C)CO)cc1 |
|
| MCULE-2830881186 |
0.66 |
C1(=CC(=C2C(OC(C3=CC=C(O)C=C3)CC2=O)=C1)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
|
| MolPort-046-657-653 |
0.66 |
C[C@H](CO)Cc1ccc(cc1)C(C)(C)C |
|
| MCULE-2149423474 |
0.66 |
C1C=C2C(OC(C3=CC=C(O)C=C3)CC2=O)=CC=1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1 |
|
| MolPort-020-256-214 |
0.66 |
CCC(OCCN)c1ccccc1 |
|
| MCULE-5872540603 |
0.66 |
C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(CO)C)OC=12 |
|
| MolPort-027-838-068 |
0.66 |
Cl.CCCC(CN)c1ccccc1 |
|
| MCULE-7552652208 |
0.66 |
C12C3C=CC=CC=3C=CC=1C(=O)CC(C1=CC=C(C(OC)=C1C(O)=O)OC)O2 |
|
| MolPort-046-662-053 |
0.66 |
COCc1cccc(c1)[C@@H](C)CN |
|
| MCULE-9435481307 |
0.66 |
C1(=C2CC(O)C(C)(C)OC2=C(C(=O)O)C(=C1)CCCCC)OC |
|
| MolPort-046-655-980 |
0.66 |
C[C@H](CO)C(C)c1ccc(C)cc1 |
|
| MCULE-2814428222 |
0.66 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-046-668-828 |
0.66 |
C[C@@H](CO)Cc1ccc(cc1)C(C)(C)C |
|
| MCULE-9885869064 |
0.66 |
[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@@H](CC2=O)C2C=C(OC)C=C(O)C=2)C=1)CO |
|
| MolPort-046-666-743 |
0.66 |
CC(C)c1ccc(cc1)C(C)[C@@H](C)CO |
|
| MCULE-6464026618 |
0.66 |
C12C=CC(OCC(=O)OCC)=CC=1OC(CC2=O)(C)C |
|
| MolPort-027-896-294 |
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CC(C)(C)c1cccc(CCN)c1 |
|
| MCULE-8070790682 |
0.66 |
C12OC(CC(=O)C=1C=C(C(OCC1C=CC(N(=O)=O)=CC=1)=C2)OCC1=CC=C(N(=O)=O)C=C1)(C)C |
|
| MolPort-046-657-463 |
0.66 |
CCc1ccc(cc1)C(C)C(C)CO |
|
| MCULE-3642569299 |
0.66 |
C1C=C2C(=O)[C@@]3(O)C4C=C(OC)C(OC)=CC=4OC[C@@]3([H])OC2=C2C[C@H](C(O)(C)C)OC=12 |
|
| MolPort-046-657-649 |
0.66 |
CCc1ccc(C[C@H](C)CO)cc1 |
|
| MCULE-9952557572 |
0.66 |
C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC(C3C=CC(O)=C(OC)C=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-046-667-141 |
0.66 |
C[C@@H](CO)C(C)c1ccc(C)cc1 |
|
| MCULE-1634327239 |
0.66 |
C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=C(OC(=O)C)C=3)[C@H](OC(=O)C)CC2=C(OC(=O)C)C=1 |
|
| MolPort-046-668-823 |
0.66 |
CCc1ccc(C[C@@H](C)CO)cc1 |
|
| MCULE-8904129896 |
0.66 |
N(=O)(=O)C1C=CC2=C(C(=O)CC(C3C=CC4=C(OCCO4)C=3)O2)C=1 |
|
| MolPort-046-657-464 |
0.66 |
CC(C)c1ccc(cc1)C(C)C(C)CO |
|
| MCULE-7381526517 |
0.66 |
C1(O[C@H]2[C@H](O)[C@](CO)(O)CO2)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1 |
|
| MolPort-046-666-742 |
0.66 |
CCc1ccc(cc1)C(C)[C@@H](C)CO |
|
| MCULE-4584299007 |
0.66 |
C12C=C(F)C=CC=1OC(CC2=O)C1=CC=C2C(OCCCO2)=C1 |
|
| MolPort-046-650-353 |
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CCc1cccc(c1)[C@H](C)CN |
|
| MolPort-046-662-038 |
0.66 |
CC(C)c1cccc(c1)[C@@H](C)CN |
|
| MolPort-046-671-871 |
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CC(C)c1cccc(c1)[C@H](C)CN |
|
| MolPort-046-651-650 |
0.66 |
CCc1ccc(cc1)C(C)[C@H](C)CO |
|
| MolPort-046-655-970 |
0.66 |
CC(C)c1ccc(cc1)C(C)[C@H](C)CO |
|
| MolPort-046-657-653 |
0.66 |
C[C@H](CO)Cc1ccc(cc1)C(C)(C)C |
|
| MolPort-046-629-108 |
0.66 |
Cl.Cl.NCC(N)c1ccc(CO)cc1 |
|
| MolPort-046-659-195 |
0.66 |
CCc1cccc(c1)[C@@H](C)CN |
|
| MolPort-038-384-218 |
0.66 |
N[C@H](Cc1ccccc1)c1ccccc1 |
|
| MolPort-035-765-240 |
0.66 |
Cl.N[C@@H]1C[C@H]1c1cccc2ccccc12 |
|
| MolPort-035-765-338 |
0.66 |
Cl.N[C@@H]1C[C@H]1c1ccc2ccccc2c1 |
|
| MolPort-044-729-230 |
0.66 |
CC(C)Cc1ccccc1CO |
|
| MolPort-042-683-193 |
0.66 |
OCc1ccc(cc1)C12CC(C1)C2 |
|
| MolPort-038-384-506 |
0.66 |
Cl.Cc1ccc(cc1)[C@H](CN)CO |
|
| MolPort-038-384-219 |
0.66 |
N[C@@H](Cc1ccccc1)c1ccccc1 |
|
| MolPort-044-729-476 |
0.66 |
CCCc1ccccc1CO |
|
| MolPort-016-635-579 |
0.66 |
Cl.Cc1cccc(CCN)c1 |
|
| MolPort-038-384-507 |
0.66 |
Cl.Cc1ccc(cc1)[C@@H](CN)CO |
|
| MolPort-035-749-112 |
0.66 |
CC(C(CN)CO)c1ccccc1 |
|
| MolPort-046-658-076 |
0.66 |
COCc1cccc(c1)[C@H](C)CN |
|
| MolPort-021-622-953 |
0.66 |
CC(C)C(O)c1ccccc1N |
|
| MolPort-046-659-195 |
0.66 |
CCc1cccc(c1)[C@@H](C)CN |
|
| MolPort-046-655-970 |
0.66 |
CC(C)c1ccc(cc1)C(C)[C@H](C)CO |
|
| MolPort-046-671-871 |
0.66 |
CC(C)c1cccc(c1)[C@H](C)CN |
|
| MolPort-003-990-079 |
0.66 |
Cc1cccc(CC(N)C(O)=O)c1 |
|
| MolPort-009-680-831 |
0.66 |
Cl.N[C@@H](Cc1ccc2ccccc2c1)C(O)=O |
|
| MolPort-035-765-395 |
0.66 |
Cl.NC1(CO)Cc2ccccc2C1 |
|
| MolPort-001-758-744 |
0.66 |
Cc1cccc(C[C@H](N)C(O)=O)c1 |
|
| MolPort-044-831-716 |
0.66 |
Cl.N[C@@H](CO)Cc1ccc(F)cc1 |
|
| MolPort-021-622-953 |
0.66 |
CC(C)C(O)c1ccccc1N |
|
| MolPort-003-698-405 |
0.66 |
CCC(O)c1ccc(Br)cc1 |
|
| MolPort-046-662-053 |
0.66 |
COCc1cccc(c1)[C@@H](C)CN |
|
| MolPort-046-658-076 |
0.66 |
COCc1cccc(c1)[C@H](C)CN |
|
| MolPort-046-629-108 |
0.66 |
Cl.Cl.NCC(N)c1ccc(CO)cc1 |
|
| MolPort-038-384-218 |
0.66 |
N[C@H](Cc1ccccc1)c1ccccc1 |
|
| MolPort-005-237-078 |
0.66 |
Cc1ccccc1C1(CN)CC1 |
|
| MolPort-008-426-834 |
0.66 |
CC(O)c1ccc2CCc3cccc1c23 |
|
| MolPort-008-644-245 |
0.66 |
CC(C)C(N)c1cccc(C)c1 |
|
| MolPort-046-662-038 |
0.66 |
CC(C)c1cccc(c1)[C@@H](C)CN |
|
| MolPort-035-749-112 |
0.66 |
CC(C(CN)CO)c1ccccc1 |
|
| MolPort-038-384-219 |
0.66 |
N[C@@H](Cc1ccccc1)c1ccccc1 |
|
| MolPort-038-384-506 |
0.66 |
Cl.Cc1ccc(cc1)[C@H](CN)CO |
|
| MolPort-002-910-688 |
0.66 |
CN(C)CC(C)(C)C(C)(O)c1cccc(C)c1 |
|
| MolPort-009-680-830 |
0.66 |
Cl.N[C@H](Cc1cccc2ccccc12)C(O)=O |
|
| MolPort-001-794-449 |
0.66 |
NC(Cc1ccccc1)c1ccccc1 |
|
| MolPort-020-256-214 |
0.66 |
CCC(OCCN)c1ccccc1 |
|
| MolPort-023-135-115 |
0.66 |
Cl.CC(N)C(O)c1ccc(F)c(F)c1 |
|
| MolPort-020-168-377 |
0.66 |
Cl.CCC(N)C(O)c1ccccc1F |
|
| MolPort-006-170-571 |
0.66 |
CN[C@H]1Cc2ccccc2[C@@H]1O |
|
| MolPort-035-680-036 |
0.66 |
N[C@H](CF)[C@H](O)c1ccc(I)cc1 |
|
| MolPort-011-654-888 |
0.66 |
CC(C(O)c1ccccc1)N1CCCCC1 |
|
| MolPort-012-439-315 |
0.66 |
COC(C(C)N)c1ccccc1Cl |
|
| MolPort-002-818-824 |
0.66 |
CC[C@H](N)[C@H](O)c1ccc(OC)cc1 |
|
| MolPort-002-821-612 |
0.66 |
COC(C(C)NCCO)c1ccccc1 |
|
| MolPort-046-701-799 |
0.66 |
CN[C@@H]1Cc2ccccc2[C@H]1O |
|
| MolPort-022-952-313 |
0.66 |
CC(C)NC(C)C(O)c1ccc(Br)cc1 |
|
| MolPort-030-267-540 |
0.66 |
CC(C)C(N)C(O)c1cccc(c1)C(F)(F)F |
|
| MolPort-044-203-189 |
0.66 |
Cl.CC(N)(CO)Cc1ccc(F)cc1 |
|
| MolPort-005-932-449 |
0.66 |
Cl.N[C@@H](Cc1cccc2ccccc12)C(O)=O |
|
| MolPort-030-005-005 |
0.66 |
Cl.NC(CO)Cc1ccc(F)cc1 |
|
| MolPort-044-194-931 |
0.66 |
Cl.NC(Cc1ccc2ccccc2c1)C(O)=O |
|
| MolPort-009-680-721 |
0.66 |
Cl.N[C@H](Cc1ccc2ccccc2c1)C(O)=O |
|
| MolPort-001-758-743 |
0.66 |
Cc1cccc(C[C@@H](N)C(O)=O)c1 |
|
| MolPort-008-645-244 |
0.66 |
Cc1cccc(c1)C(N)C(C)(C)C |
|
| MolPort-002-471-523 |
0.66 |
NCC1(CCC1)c1ccccc1 |
|
| MolPort-035-765-338 |
0.66 |
Cl.N[C@@H]1C[C@H]1c1ccc2ccccc2c1 |
|
| MolPort-003-742-203 |
0.66 |
CC(CN)(CO)Cc1ccccc1 |
|
| MolPort-003-742-172 |
0.66 |
NCC(CO)Cc1ccccc1 |
|
| MolPort-004-302-238 |
0.66 |
NC(Cc1ccccc1)C#N |
|
| MolPort-014-000-465 |
0.66 |
CCCc1ccc(cc1)C(O)c1ccccc1 |
|
| MolPort-044-729-476 |
0.66 |
CCCc1ccccc1CO |
|
| MolPort-035-765-240 |
0.66 |
Cl.N[C@@H]1C[C@H]1c1cccc2ccccc12 |
|
| MolPort-003-981-911 |
0.66 |
CC[C@@H](N)c1cccc(C)c1 |
|
| MolPort-003-981-910 |
0.66 |
CC[C@H](N)c1cccc(C)c1 |
|
| MolPort-027-838-068 |
0.66 |
Cl.CCCC(CN)c1ccccc1 |
|
| MolPort-016-630-852 |
0.66 |
CC1(C)CC1(CN)c1ccccc1 |
|
| MolPort-000-160-558 |
0.66 |
CC(CO)Cc1ccc(cc1)C(C)(C)C |
|
| MolPort-008-494-185 |
0.66 |
CC(C)(C)c1ccc(CCCO)cc1 |
|
| MolPort-046-666-743 |
0.66 |
CC(C)c1ccc(cc1)C(C)[C@@H](C)CO |
|
| MolPort-046-666-742 |
0.66 |
CCc1ccc(cc1)C(C)[C@@H](C)CO |
|
| MolPort-046-668-823 |
0.66 |
CCc1ccc(C[C@@H](C)CO)cc1 |
|
| MolPort-008-494-173 |
0.66 |
Cc1ccc(CCCO)cc1 |
|
| MolPort-008-494-176 |
0.66 |
CCc1ccc(CCCO)cc1 |
|
| MolPort-046-667-141 |
0.66 |
C[C@@H](CO)C(C)c1ccc(C)cc1 |
|
| MolPort-044-729-230 |
0.66 |
CC(C)Cc1ccccc1CO |
|
| MolPort-042-683-193 |
0.66 |
OCc1ccc(cc1)C12CC(C1)C2 |
|
| MolPort-011-913-698 |
0.66 |
CCCC(N)Cc1ccccc1 |
|
| MolPort-008-491-951 |
0.66 |
NCC(C1CC1)c1ccccc1 |
|
| MolPort-038-384-507 |
0.66 |
Cl.Cc1ccc(cc1)[C@@H](CN)CO |
|
| MolPort-042-623-102 |
0.65 |
Cl.Cc1ccc(CCN)cc1C |
|
| MolPort-038-384-498 |
0.65 |
Cl.NC[C@@H](CO)c1ccccc1 |
|
| MolPort-046-594-078 |
0.65 |
C[C@H](CO)Cc1ccccc1 |
|
| MolPort-020-096-866 |
0.65 |
Cl.Cc1ccc(CCN)cc1 |
|
| MolPort-046-659-515 |
0.65 |
C[C@H](CO)C(C)(C)c1ccccc1 |
|
| MolPort-046-653-925 |
0.65 |
C[C@@H](CO)C(C)c1ccccc1 |
|
| MolPort-046-664-196 |
0.65 |
C[C@@H](CO)C(C)(C)c1ccccc1 |
|
| MolPort-046-650-684 |
0.65 |
C[C@H](CO)C(C)c1ccccc1 |
|
| MolPort-045-999-085 |
0.65 |
Cl.Cl.NCCc1ccc(CCN)cc1 |
|
| MolPort-044-619-654 |
0.65 |
OC(=O)C(O)=O.N[C@@H]1CO[C@H]1c1ccccc1 |
|
| MolPort-027-845-140 |
0.65 |
Cl.COC(C(C)N)c1ccc(OC)cc1 |
|
| MolPort-027-845-385 |
0.65 |
Cl.COC(C(C)N)c1ccccc1F |
|
| MolPort-021-784-844 |
0.65 |
Cl.CCc1cc2CC(N)Cc2cc1CC |
|
| MolPort-029-939-309 |
0.65 |
Cl.CNC(COC)Cc1ccccc1 |
|
| MolPort-029-938-986 |
0.65 |
Cl.Cc1cccc(CC(N)C(O)=O)c1 |
|
| MolPort-023-049-015 |
0.65 |
CC(C)(N)Cc1ccc2CCCCc2c1 |
|
| MolPort-046-671-851 |
0.65 |
C[C@H](CN)c1ccc2CCCCc2c1 |
|
| MolPort-046-069-126 |
0.65 |
Cl.Cc1cc(C)cc(C[C@H](N)C(O)=O)c1 |
|
| MolPort-020-372-793 |
0.65 |
CN(CCc1ccccc1)CC(O)c1ccccc1 |
|
| MolPort-042-683-557 |
0.65 |
Cl.CC(O)C(N)c1ccccc1 |
|
| MolPort-046-651-374 |
0.65 |
C[C@@H](CN)c1ccc2CCCCc2c1 |
|
| MolPort-035-778-575 |
0.65 |
CCCC(O)c1cccc(c1)C(C)C |
|
| MolPort-027-632-278 |
0.65 |
CCCC(O)c1cccc(CC)c1 |
|
| MolPort-025-503-327 |
0.65 |
OC(CCC(O)c1ccccc1)c1ccccc1 |
|
| MolPort-029-997-674 |
0.65 |
Cl.NCC(O)c1ccccc1Br |
|
| MolPort-030-005-501 |
0.65 |
Cl.NC[C@@H](O)c1ccc(F)cc1 |
|
| MolPort-039-008-374 |
0.65 |
CC(C)Cc1cccc(c1)C(C)C(N)=O |
|
| MolPort-020-248-025 |
0.65 |
CC(O)(CN)c1ccccc1Cl |
|
| MolPort-038-948-855 |
0.65 |
Cc1cc(C)cc(c1)[C@@H]1CCC[C@H]1N |
|
| MolPort-035-789-284 |
0.65 |
Cl.CC(O)(CN)c1ccccc1Br |
|
| MolPort-035-781-249 |
0.65 |
CCCC(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-020-364-039 |
0.65 |
CC(O)(CN)CCc1ccccc1 |
|
| MolPort-021-708-250 |
0.65 |
CCC(O)(C#C)c1ccccc1 |
|
| MolPort-030-005-507 |
0.65 |
Cl.NC[C@H](O)c1ccc(F)cc1 |
|
| MolPort-046-682-909 |
0.65 |
Cl.C[C@H](O)[C@@H](N)c1ccccc1 |
|
| MolPort-046-791-646 |
0.65 |
CC(F)(F)C(O)c1ccccc1 |
|
| MolPort-035-770-172 |
0.65 |
Cl.CC(C)(O)[C@@H](N)c1ccccc1 |
|
| MolPort-035-778-126 |
0.65 |
CCCC(C)(O)c1cccc(c1)C(C)C |
|
| MolPort-044-562-187 |
0.65 |
Cl.C[C@H](O)[C@H](N)c1ccccc1 |
|
| MolPort-026-526-587 |
0.65 |
CCC(O)(CC)c1cc(C)c(C)cc1C |
|
| MolPort-025-494-882 |
0.65 |
CCCC(C)(O)c1cccc(CC)c1 |
|
| MolPort-035-770-173 |
0.65 |
Cl.CC(C)(O)[C@H](N)c1ccccc1 |
|
| MolPort-035-779-496 |
0.65 |
CCC(O)(CC)c1ccccc1C(C)C |
|
| MolPort-044-562-186 |
0.65 |
Cl.C[C@@H](O)[C@H](N)c1ccccc1 |
|
| MolPort-035-778-238 |
0.65 |
CCc1ccccc1C(O)(CC)CC |
|
| MCULE-7271133303 |
0.65 |
C1(OC)C(/C=C/C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=CC=1 |
|
| MCULE-1769245850 |
0.65 |
OC1C=CC(=CC=1)C1OC2C(=C(C=C(O)C=2)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(=O)C1 |
|
| MCULE-1362714791 |
0.65 |
O=C1C2C(=CC=CC=2OC(C)(C)C1)OC |
|
| MCULE-8793012880 |
0.65 |
C(C)(=O)OC1=CC2=C(C(C(C(C)O2)C(C)=O)=O)C=C1 |
|
| MCULE-9637977634 |
0.65 |
C12C(Br)=CC(=CC=1C(CC(C1=CC=CC=C1)O2)=O)Br |
|
| MCULE-8980836702 |
0.65 |
C12OC3(CCCCC3)CC(=O)C=1C=CC(O)=C2O |
|
| MCULE-4002824005 |
0.65 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2C(=CC=1)C(=O)C[C@H](O2)C1=CC=CC=C1 |
|
| MCULE-9790777412 |
0.65 |
C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@@H](OC)C2=CC=1 |
|
| MCULE-8605141998 |
0.65 |
C1(OC)C(/C=C/C(O)(C)C)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1 |
|
| MCULE-5830685626 |
0.65 |
C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CCC2=CC=1 |
|
| MCULE-9181884957 |
0.65 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(OC)=O)=O |
|
| MCULE-6254841864 |
0.65 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@@H](O2)CO)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1 |
|
| MCULE-2510689712 |
0.65 |
C12OC3(CCC(CC3)C)CC(=O)C=1C=CC(O)=C2O |
|
| MCULE-2628037339 |
0.65 |
C1C=C2OC(C3C=CC=CC=3Cl)CC(=O)C2=CC=1 |
|
| MCULE-5756285409 |
0.65 |
OC1C2C(=O)CC3(OC=2C=C(O)C=1)CCC3 |
|
| MCULE-5340068339 |
0.65 |
[C@H]1(OC2=C(C=CC=C2)C(=O)[C@H]1OS(=O)(=O)C)C1C=CC(C(C)C)=CC=1 |
|
| MCULE-6273079015 |
0.65 |
C1(C2=CC=CC=C2Cl)CC(=O)C2C(=CC=C(OC)C=2)O1 |
|
| MCULE-9748121668 |
0.65 |
O1C(C)C(C2C=CC3=C(C=2)OCCO3)C(C2C=C(CCC)C(OC)=CC1=2)=O |
|
| MCULE-3722830096 |
0.65 |
C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@H](OC)C2=CC=1 |
|
| MCULE-2120677871 |
0.65 |
C12=CC(=CC=C1OC(CC2=O)(C)C)C(O)=O |
|
| MCULE-6920051494 |
0.65 |
O1C2C=CC=CC=2C(CC1C1=CC=C(C(COC2C=C(C)C(=CC=2C(C)C)Cl)=C1)OC)=O |
|
| MCULE-3220376293 |
0.65 |
C1(OCC2C=CC=CC=2)C=C(OC)C=CC=1CC(OC)C(O)C1=CC=CC=C1 |
|
| MCULE-6715037033 |
0.65 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=CC=1)C1C=CC=CC=1 |
|
| MCULE-9844966637 |
0.65 |
C1(=CC=C(O)C(=C1)S(ON)(=O)=O)C1CC(=O)C2C(=CC(=CC=2O)O)O1 |
|
| MCULE-6709417192 |
0.65 |
C(#N)COC1=CC2OC(C)(C)CC(=O)C=2C=C1 |
|
| MCULE-2609806815 |
0.65 |
C12=CC(C)=C(C=C1OC(C1=CC=CC=C1C(O)=O)CC2=O)C |
|
| MolPort-006-709-938 |
0.65 |
NC(Cc1ccccc1)C(O)CF |
|
| MolPort-001-781-725 |
0.65 |
OCCCc1ccccc1 |
|
| MolPort-020-096-866 |
0.65 |
Cl.Cc1ccc(CCN)cc1 |
|
| MolPort-006-118-708 |
0.65 |
CC(CO)Cc1ccccc1 |
|
| MolPort-046-659-515 |
0.65 |
C[C@H](CO)C(C)(C)c1ccccc1 |
|
| MolPort-046-594-078 |
0.65 |
C[C@H](CO)Cc1ccccc1 |
|
| MolPort-045-999-085 |
0.65 |
Cl.Cl.NCCc1ccc(CCN)cc1 |
|
| MolPort-046-664-196 |
0.65 |
C[C@@H](CO)C(C)(C)c1ccccc1 |
|
| MolPort-027-845-140 |
0.65 |
Cl.COC(C(C)N)c1ccc(OC)cc1 |
|
| MolPort-044-619-654 |
0.65 |
OC(=O)C(O)=O.N[C@@H]1CO[C@H]1c1ccccc1 |
|
| MolPort-001-792-462 |
0.65 |
CSc1ccc(cc1)[C@H](O)[C@@H](N)CO |
|
| MolPort-008-492-707 |
0.65 |
Cc1ccc2CCC(O)(CN)c2c1 |
|
| MolPort-003-850-192 |
0.65 |
Cl.C[C@H](NCCc1ccc(O)cc1)[C@H](O)c1ccc(O)cc1 |
|
| MolPort-008-482-932 |
0.65 |
NCCC(O)c1ccc(Br)cc1 |
|
| MolPort-012-675-813 |
0.65 |
CCC(O)(C(N)=O)c1ccc(Br)cc1 |
|
| MolPort-000-725-693 |
0.65 |
COP([S-])(=O)OC.C[NH2+]C(C)C(O)c1ccccc1 |
|
| MolPort-046-650-684 |
0.65 |
C[C@H](CO)C(C)c1ccccc1 |
|
| MolPort-027-845-385 |
0.65 |
Cl.COC(C(C)N)c1ccccc1F |
|
| MolPort-003-959-434 |
0.65 |
Cl.C[C@@H](NCCc1ccc(O)cc1)[C@@H](O)c1ccc(O)cc1 |
|
| MolPort-021-784-844 |
0.65 |
Cl.CCc1cc2CC(N)Cc2cc1CC |
|
| MolPort-016-636-385 |
0.65 |
Cl.Cc1cc(C)cc(CC(N)C(O)=O)c1 |
|
| MolPort-029-938-986 |
0.65 |
Cl.Cc1cccc(CC(N)C(O)=O)c1 |
|
| MolPort-029-939-309 |
0.65 |
Cl.CNC(COC)Cc1ccccc1 |
|
| MolPort-046-651-374 |
0.65 |
C[C@@H](CN)c1ccc2CCCCc2c1 |
|
| MolPort-023-049-015 |
0.65 |
CC(C)(N)Cc1ccc2CCCCc2c1 |
|
| MolPort-046-069-126 |
0.65 |
Cl.Cc1cc(C)cc(C[C@H](N)C(O)=O)c1 |
|
| MolPort-046-671-851 |
0.65 |
C[C@H](CN)c1ccc2CCCCc2c1 |
|
| MolPort-002-511-016 |
0.65 |
NC(Cc1cccc(CC(N)C(O)=O)c1)C(O)=O |
|
| MolPort-046-653-925 |
0.65 |
C[C@@H](CO)C(C)c1ccccc1 |
|
| MolPort-001-778-670 |
0.65 |
NCC(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-038-384-497 |
0.65 |
Cl.NC[C@H](CO)c1ccccc1 |
|
| MolPort-020-372-793 |
0.65 |
CN(CCc1ccccc1)CC(O)c1ccccc1 |
|
| MolPort-030-005-501 |
0.65 |
Cl.NC[C@@H](O)c1ccc(F)cc1 |
|
| MolPort-008-512-901 |
0.65 |
Cc1cccc(c1)C1(CN)CCCC1 |
|
| MolPort-003-748-960 |
0.65 |
NCC(O)c1ccccc1Cl |
|
| MolPort-001-778-669 |
0.65 |
Cl.NCC(O)c1ccc(F)cc1 |
|
| MolPort-029-997-674 |
0.65 |
Cl.NCC(O)c1ccccc1Br |
|
| MolPort-013-042-205 |
0.65 |
CCCN(C)CC(O)c1ccccc1 |
|
| MolPort-027-632-278 |
0.65 |
CCCC(O)c1cccc(CC)c1 |
|
| MolPort-013-118-201 |
0.65 |
OC(CC1CC1)c1ccccc1 |
|
| MolPort-001-757-027 |
0.65 |
CC(C)Cc1ccc(cc1)C(C)C(N)=O |
|
| MolPort-046-791-646 |
0.65 |
CC(F)(F)C(O)c1ccccc1 |
|
| MolPort-035-778-238 |
0.65 |
CCc1ccccc1C(O)(CC)CC |
|
| MolPort-011-090-444 |
0.65 |
NCC(O)CCc1ccccc1 |
|
| MolPort-035-778-575 |
0.65 |
CCCC(O)c1cccc(c1)C(C)C |
|
| MolPort-035-778-126 |
0.65 |
CCCC(C)(O)c1cccc(c1)C(C)C |
|
| MolPort-035-770-173 |
0.65 |
Cl.CC(C)(O)[C@H](N)c1ccccc1 |
|
| MolPort-003-925-954 |
0.65 |
Cl.NCC(O)c1cccc(O)c1 |
|
| MolPort-002-219-178 |
0.65 |
OC(CNCCc1ccccc1)c1ccccc1 |
|
| MolPort-038-384-498 |
0.65 |
Cl.NC[C@@H](CO)c1ccccc1 |
|
| MolPort-039-008-374 |
0.65 |
CC(C)Cc1cccc(c1)C(C)C(N)=O |
|
| MolPort-002-801-419 |
0.65 |
CCN(CC)CC(O)c1ccc(cc1)C1CCCC1 |
|
| MolPort-042-592-838 |
0.65 |
CC(Cc1ccc(O)cc1)N(C)C[C@@H](O)c1ccccc1 |
|
| MolPort-002-801-423 |
0.65 |
CC(C)NCC(O)c1ccc(cc1)C1CCCC1 |
|
| MolPort-035-789-284 |
0.65 |
Cl.CC(O)(CN)c1ccccc1Br |
|
| MolPort-001-793-536 |
0.65 |
NCC(O)c1ccccc1F |
|
| MolPort-003-666-490 |
0.65 |
Cl.CC(C)NCC(O)c1ccc2ccccc2c1 |
|
| MolPort-015-097-121 |
0.65 |
Cc1cc(C)cc(c1)C1(CN)CCCC1 |
|
| MolPort-006-013-351 |
0.65 |
NCC(O)c1cccc(Br)c1 |
|
| MolPort-000-000-750 |
0.65 |
Cl.NCC(O)c1ccccc1Cl |
|
| MolPort-020-248-025 |
0.65 |
CC(O)(CN)c1ccccc1Cl |
|
| MolPort-016-584-949 |
0.65 |
CC(CN(C)CC(O)c1ccccc1)c1ccccc1 |
|
| MolPort-006-116-175 |
0.65 |
OCCNCC(O)c1ccccc1 |
|
| MolPort-008-546-111 |
0.65 |
CCNCC(O)c1ccc(C)cc1 |
|
| MolPort-008-546-688 |
0.65 |
CC(C)CNCC(O)c1ccccc1 |
|
| MolPort-038-948-855 |
0.65 |
Cc1cc(C)cc(c1)[C@@H]1CCC[C@H]1N |
|
| MolPort-035-770-172 |
0.65 |
Cl.CC(C)(O)[C@@H](N)c1ccccc1 |
|
| MolPort-042-683-557 |
0.65 |
Cl.CC(O)C(N)c1ccccc1 |
|
| MolPort-001-761-226 |
0.65 |
O[C@@H](CCCl)c1ccccc1 |
|
| MolPort-001-761-227 |
0.65 |
O[C@H](CCCl)c1ccccc1 |
|
| MolPort-025-494-882 |
0.65 |
CCCC(C)(O)c1cccc(CC)c1 |
|
| MolPort-044-562-186 |
0.65 |
Cl.C[C@@H](O)[C@H](N)c1ccccc1 |
|
| MolPort-003-661-942 |
0.65 |
OC1Cc2ccccc12 |
|
| MolPort-035-781-249 |
0.65 |
CCCC(C)(O)c1cccc(c1)C(C)(C)C |
|
| MolPort-000-928-164 |
0.65 |
OC1Cc2cccc3cccc1c23 |
|
| MolPort-001-815-593 |
0.65 |
CC(O)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-044-562-187 |
0.65 |
Cl.C[C@H](O)[C@H](N)c1ccccc1 |
|
| MolPort-025-503-327 |
0.65 |
OC(CCC(O)c1ccccc1)c1ccccc1 |
|
| MolPort-001-815-167 |
0.65 |
OC1(CCCC1)c1ccccc1 |
|
| MolPort-042-623-102 |
0.65 |
Cl.Cc1ccc(CCN)cc1C |
|
| MolPort-046-651-637 |
0.65 |
C[C@@H](CN)c1cc(C)ccc1C |
|
| MolPort-046-767-384 |
0.65 |
Cl.NCC(CO)c1ccccc1 |
|
| MolPort-046-666-717 |
0.65 |
C[C@H](CN)c1cc(C)ccc1C |
|
| MolPort-001-792-765 |
0.65 |
Cc1ccc(C)c(CCN)c1 |
|
| MolPort-002-468-251 |
0.65 |
Cc1cc(cc(C)c1CCN)C(C)(C)C |
|
| MolPort-046-682-909 |
0.65 |
Cl.C[C@H](O)[C@@H](N)c1ccccc1 |
|
| MolPort-011-186-502 |
0.65 |
CCC(Cc1ccc(C)cc1)NC |
|
| MolPort-002-539-143 |
0.65 |
O[C@]1(C2CC1C2)c1ccccc1 |
|
| MolPort-013-972-260 |
0.65 |
CC(N)(CO)CCc1ccccc1 |
|
| MolPort-008-546-081 |
0.65 |
CCCC(O)c1ccc(C)c(C)c1 |
|
| MolPort-021-708-250 |
0.65 |
CCC(O)(C#C)c1ccccc1 |
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| MolPort-013-972-248 |
0.65 |
CCC(N)(CO)c1ccccc1 |
|
| MolPort-003-930-981 |
0.65 |
C[C@H](O)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-014-879-212 |
0.65 |
CCCC(C)(O)c1ccc(C)c(C)c1 |
|
| MolPort-008-644-295 |
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CCCC(O)c1ccccc1C |
|
| MolPort-026-526-587 |
0.65 |
CCC(O)(CC)c1cc(C)c(C)cc1C |
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| MolPort-003-698-666 |
0.65 |
OC(CCCl)c1ccccc1 |
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| MolPort-009-053-855 |
0.65 |
Cl.CC(C)(C)c1ccc(cc1)C1(CN)CCC1 |
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| MolPort-035-779-496 |
0.65 |
CCC(O)(CC)c1ccccc1C(C)C |
|
| MolPort-044-432-527 |
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OC(CCBr)c1ccccc1 |
|
| MolPort-004-291-085 |
0.65 |
CCC(O)c1ccc(O)cc1 |
|
| MolPort-020-364-039 |
0.65 |
CC(O)(CN)CCc1ccccc1 |
|
| MolPort-011-893-285 |
0.65 |
CCCC(C)(O)c1ccccc1C |
|
| MolPort-008-426-764 |
0.65 |
CC(C)(CCO)c1ccccc1 |
|
| MolPort-030-005-507 |
0.65 |
Cl.NC[C@H](O)c1ccc(F)cc1 |
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| MolPort-042-592-838 |
0.65 |
CC(Cc1ccc(O)cc1)N(C)C[C@@H](O)c1ccccc1 |
|
| MolPort-044-432-527 |
0.65 |
OC(CCBr)c1ccccc1 |
|
| MolPort-046-666-717 |
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C[C@H](CN)c1cc(C)ccc1C |
|
| MolPort-038-384-497 |
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Cl.NC[C@H](CO)c1ccccc1 |
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| MolPort-046-767-384 |
0.65 |
Cl.NCC(CO)c1ccccc1 |
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| MolPort-046-651-637 |
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C[C@@H](CN)c1cc(C)ccc1C |
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| MolPort-046-690-473 |
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Cl.CC(C)NCC(O)c1ccc(C)cc1 |
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| MolPort-030-004-787 |
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OC(=O)C(F)(F)F.OC1(CNC1)c1ccccc1 |
|
| MolPort-031-201-066 |
0.64 |
NC[C@H](O)c1cccc(c1)C#N |
|
| MolPort-022-657-332 |
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CC(O)(CN)c1cccc(F)c1 |
|
| MolPort-022-657-309 |
0.64 |
CC(O)(CN)c1cccc(Cl)c1 |
|
| MolPort-046-651-375 |
0.64 |
CCc1ccc(C[C@@H](C)CN)cc1 |
|
| MolPort-035-831-232 |
0.64 |
Cl.NC[C@@H](O)c1cccc(Br)c1 |
|
| MolPort-038-949-655 |
0.64 |
Cl.Cc1cc(CC(C)(C)N)ccc1Br |
|
| MolPort-027-836-785 |
0.64 |
Cl.NC[C@@H](O)c1cccc(Cl)c1 |
|
| MolPort-035-789-419 |
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Cl.Cc1ccccc1C1(O)CNC1 |
|
| MolPort-020-121-884 |
0.64 |
Cl.CC(C)(C)CNCC(O)c1ccccc1 |
|
| MolPort-022-523-122 |
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CC(C)(CN)c1ccc2ccccc2c1 |
|
| MolPort-020-003-548 |
0.64 |
Cl.C[C@@H](CN)c1ccccc1 |
|
| MolPort-023-278-719 |
0.64 |
Cl.CC(CN)c1ccccc1 |
|
| MolPort-046-651-365 |
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C[C@@H](CN)c1cccc2ccccc12 |
|
| MolPort-046-661-276 |
0.64 |
C[C@@H](CN)c1ccc2ccccc2c1 |
|
| MolPort-042-622-995 |
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Cl.CC(C)(CN)c1ccccc1 |
|
| MolPort-046-654-816 |
0.64 |
C[C@H](CN)c1ccc2ccccc2c1 |
|
| MolPort-046-665-529 |
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C[C@H](CN)c1cccc2ccccc12 |
|
| MolPort-039-240-958 |
0.64 |
Cl.Cc1ccc(CC(N)C(O)=O)cc1C |
|
| MolPort-027-721-583 |
0.64 |
OC(=O)C(O)=O.CC(N)C(c1ccccc1)c1ccccc1 |
|
| MolPort-020-180-901 |
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Cl.CC(C(O)c1ccc2ccccc2c1)N1CCCCC1 |
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| MolPort-042-605-904 |
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CC(C)C(NCC#C)C(O)c1ccccc1 |
|
| MolPort-024-468-849 |
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CCc1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-020-168-378 |
0.64 |
Cl.CCC(N)C(O)c1c(F)cccc1F |
|
| MolPort-042-621-934 |
0.64 |
Cl.CC(N)Cc1ccc(cc1)C#N |
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| MolPort-044-586-789 |
0.64 |
Cl.CC(C)(N)Cc1ccc(cc1)C#N |
|
| MolPort-046-588-884 |
0.64 |
[Cl-].CC([NH3+])Cc1ccc(cc1)-c1ccccc1 |
|
| MolPort-035-778-987 |
0.64 |
CC(C)c1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-046-510-576 |
0.64 |
OC(CC(F)F)c1ccccc1 |
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| MolPort-044-623-112 |
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Cl.N[C@@H](CO)CCc1ccccc1 |
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| MolPort-042-605-775 |
0.64 |
Cl.NCCc1ccc(cc1)C1CCCCC1 |
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| MolPort-044-623-109 |
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Cl.N[C@H](CO)CCc1ccccc1 |
|
| MolPort-024-818-790 |
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NC(CO)C(O)c1ccc(F)c(F)c1 |
|
| MolPort-023-048-150 |
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CCCc1ccc(CC(C)(C)O)cc1 |
|
| MolPort-014-859-110 |
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CCc1ccc(CC(C)(C)O)cc1 |
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| MolPort-001-792-703 |
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Cc1ccc(CC(C)(C)O)cc1 |
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| MolPort-002-835-045 |
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CC(C)(C)c1ccc(CCCN)cc1 |
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| MolPort-046-651-375 |
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CCc1ccc(C[C@@H](C)CN)cc1 |
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| MolPort-046-666-319 |
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C[C@H](CN)Cc1ccc(C)cc1 |
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| MolPort-046-666-308 |
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CCc1ccc(C[C@H](C)CN)cc1 |
|
| MolPort-046-657-671 |
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CCc1ccc(cc1)C(C)[C@H](C)CN |
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| MolPort-046-659-623 |
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CCc1ccc(cc1)C(C)[C@@H](C)CN |
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| MolPort-023-049-431 |
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CC(C)Cc1ccc(CC(C)(C)O)cc1 |
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| MolPort-003-179-050 |
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Cc1ccc(CCCN)cc1 |
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| MolPort-035-782-175 |
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CCCc1ccc(CC(C)O)cc1 |
|
| MolPort-046-658-066 |
0.64 |
C[C@H](CN)C(C)c1ccc(C)cc1 |
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| MolPort-008-545-566 |
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CC(O)Cc1ccc(C)cc1 |
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| MolPort-014-859-227 |
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CCc1ccc(CC(C)O)cc1 |
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| MolPort-008-507-501 |
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CC(C)(O)Cc1ccc(cc1)C(C)(C)C |
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| MolPort-013-889-069 |
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CC(O)Cc1ccc(cc1)C(C)C |
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| MolPort-046-657-672 |
0.64 |
CC(C)c1ccc(cc1)C(C)[C@H](C)CN |
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| MolPort-046-651-381 |
0.64 |
C[C@@H](CN)Cc1ccc(cc1)C(C)C |
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| MolPort-039-240-958 |
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Cl.Cc1ccc(CC(N)C(O)=O)cc1C |
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| MolPort-035-782-185 |
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CC(C)Cc1ccc(CC(C)O)cc1 |
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| MolPort-046-666-320 |
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C[C@H](CN)Cc1ccc(cc1)C(C)C |
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| MolPort-013-889-064 |
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CC(O)Cc1ccc(cc1)C(C)(C)C |
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| MolPort-042-622-995 |
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Cl.CC(C)(CN)c1ccccc1 |
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CC(O)c1cccc2ccccc12 |
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| MolPort-002-051-515 |
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CC(C)(O)c1cccc2ccccc12 |
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| MolPort-002-499-501 |
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C[C@H](O)c1cccc2ccccc12 |
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| MolPort-003-659-049 |
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Cl.NCCc1ccccc1 |
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CC(O)c1ccc2ccccc2c1 |
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| MolPort-046-661-276 |
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C[C@@H](CN)c1ccc2ccccc2c1 |
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| MolPort-046-665-529 |
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C[C@H](CN)c1cccc2ccccc12 |
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| MolPort-003-733-106 |
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CC(C)c1ccc(CCCN)cc1 |
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CC(C)c1ccc(CC(C)(C)O)cc1 |
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C[C@@H](CN)C(C)c1ccc(C)cc1 |
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| MolPort-046-661-700 |
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C[C@@H](CN)Cc1ccc(C)cc1 |
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| MolPort-008-647-553 |
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CC(C)Cc1ccc(cc1)C(C)CO |
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| MolPort-046-661-284 |
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C[C@@H](CN)Cc1ccc(cc1)C(C)(C)C |
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| MolPort-046-652-278 |
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CC(C)c1ccc(cc1)C(C)[C@@H](C)CN |
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| MCULE-5687409494 |
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NC(C1=CC=C(COC2=CC3=C(C(CC4(O3)CCCCC4)=O)C=C2)C=C1)=O |
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| MolPort-008-645-366 |
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CC(C)Cc1ccc(CCO)cc1 |
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| MCULE-3547152350 |
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C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@](O)(CO)CO3)O2)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
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| MolPort-002-498-520 |
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CCCc1ccc(CCO)cc1 |
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| MCULE-8575121647 |
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CC1OC(OC2C(OC3C=C4C(C(CC(C5C=CC(OC)=CC=5)O4)=O)=C(O)C=3)OC(CO)C(O)C2O)C(O)C(O)C1O |
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| MolPort-028-957-599 |
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Cl.NCC1(CCC1)c1ccccc1 |
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| MCULE-9075240189 |
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C12C=C(C=C(O)C=1C(=O)C[C@@H](C1=CC=C(O)C=C1)O2)O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO[C@@H]2O[C@H]([C@H](O)[C@@H](O)[C@H]2O)C)O1)O |
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| MolPort-003-184-789 |
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OC(CCN1CCC(C1)c1ccccc1)c1ccccc1 |
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| MCULE-6741116097 |
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C1(O)C=C2O[C@H](C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@H]4[C@H](O)[C@@](O)(CO)CO4)=CC=3)CC(=O)C2=CC=1 |
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| MolPort-011-914-165 |
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CCC(Cc1ccccc1)NC |
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| MCULE-3494790566 |
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CC1(OC2=C(C=CC(=C2)OCCOC2=CC=C(F)C=C2)C(=O)C1)C |
|
| MolPort-000-155-015 |
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N[C@@H]([C@H](N)c1ccccc1)c1ccccc1 |
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| MCULE-4060250781 |
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C12O[C@@H](C(C)C)CC1=C1O[C@]3([H])COC4C(=CC(OC)=C(OC)C=4)[C@]3([H])C(=O)C1=CC=2 |
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| MolPort-046-651-365 |
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C[C@@H](CN)c1cccc2ccccc12 |
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| MCULE-9041582960 |
0.64 |
C1(O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1 |
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CC(N)(Cc1ccccc1)C1CC1 |
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C1C=C2OC(C)(C)CC(=O)C2=CC=1C(C)=O |
|
| MolPort-002-501-546 |
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N[C@H](CCO)c1ccccc1 |
|
| MCULE-5348711723 |
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[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@@H](CC2=O)C2=CC=C(C=C2)O)C=1)CO |
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| MolPort-005-312-031 |
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Cl.NC(Cc1ccccc1)C#N |
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| MCULE-7523413286 |
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C12=CC(=CC=C1C(CC1(CCC(CC1)C)O2)=O)OCC(O)=O |
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| MolPort-021-783-768 |
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Cl.CC[C@@H](N)c1cccc(C)c1 |
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| MCULE-5276130159 |
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[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@H](CC2=O)C2=CC=C(C=C2)O)C=1)CO |
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| MolPort-004-754-833 |
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Cc1cccc(c1)C1(N)CC1 |
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| MCULE-7474710506 |
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C12C=C(C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O)OCC(O)=O |
|
| MolPort-002-054-163 |
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NC(CCO)c1ccccc1 |
|
| MCULE-4823752475 |
0.64 |
C1(OC)C(C)=C2OC(C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]5[C@H](O)[C@@](O)(CO)CO5)O4)=CC=3)CC(=O)C2=C(O)C=1C |
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| MolPort-016-899-541 |
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CC(C)(CO)C(N)c1ccccc1 |
|
| MCULE-5577419993 |
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O1C2C=CC=CC=2C(CC1C1=CC=C(C(COC2C=CC(=CC=2Cl)Cl)=C1)OC)=O |
|
| MolPort-020-093-500 |
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NC1CCC1c1ccccc1 |
|
| MCULE-8139618331 |
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C1(C)(C)OC2=C(C=CC(C(OCC)=O)=C2)C(=O)C1 |
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N[C@@H](CCO)c1ccccc1 |
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| MCULE-7338372949 |
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C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(O)=O |
|
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0.64 |
N[C@@H]([C@@H](N)c1ccccc1)c1ccccc1 |
|
| MCULE-1697925984 |
0.64 |
OC1C=C(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C=C2O[C@@H](C3C=CC(O)=CC=3)CC(=O)C=12 |
|
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Cc1cccc(CC(CN)CO)c1 |
|
| MCULE-2808039967 |
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O1C2=CC(OC)=C(OC)C=C2C2(C(C3C(=C4CC(C(C)C)OC4=CC=3)OC2(C1)[H])=O)[H] |
|
| MolPort-013-383-020 |
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OC1(CC1)c1ccc(Br)cc1 |
|
| MCULE-7760204952 |
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C12C(O)=CC(=CC=1OC(CC2=O)(C)C)CC1C=CC=CC=1 |
|
| MolPort-000-001-027 |
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NCCc1ccc(cc1)C(O)=O |
|
| MCULE-8294517353 |
0.64 |
[C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OS(=O)(=O)C)C1C=CC(Br)=CC=1 |
|
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CCC(O)(CC)c1ccccc1N |
|
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0.64 |
C1(=O)CC(C2C=CC(=CC=2)N(C)C)OC2C=C(C)C=C(C)C1=2 |
|
| MolPort-014-185-616 |
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CCC(O)c1ccccc1Br |
|
| MCULE-9896770923 |
0.64 |
C1(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C2OC(C3C=CC(O[C@@H]4O[C@H](CO[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](O)[C@H](O)[C@H]4O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-013-880-560 |
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CNCC1(CC1)c1ccccc1 |
|
| MCULE-5452697247 |
0.64 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-044-878-292 |
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Cl.CCC(N)c1cc(C)cc(C)c1 |
|
| MCULE-5928838038 |
0.64 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-045-971-481 |
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Cl.Cl.CC(Cc1ccccc1)NN |
|
| MCULE-9072378494 |
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O(C[C@@H]1[C@H]([C@@H]([C@H]([C@H](OC2C=C3OC(C4C=CC(OC)=CC=4)CC(=O)C3=C(O)C=2)O1)O)O)O)[C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O |
|
| MolPort-000-155-016 |
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N[C@H]([C@@H](N)c1ccccc1)c1ccccc1 |
|
| MCULE-1472229997 |
0.64 |
O(C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC1C=C2OC(C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1)O)O)O)[C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O |
|
| MolPort-035-789-399 |
0.64 |
CC1(C)[C@H](N)[C@H]1c1ccccc1 |
|
| MCULE-7833385381 |
0.64 |
C1(O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC=3)CC(=O)C2=C(O)C=1 |
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| MolPort-028-610-245 |
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CC(C)(CO)[C@@H](N)c1ccccc1 |
|
| MCULE-1473840812 |
0.64 |
O(C)C1C=CC([C@@H]2OC3=CC(O[C@H]4[C@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC(O)=C3C(=O)C2)=CC=1 |
|
| MolPort-038-949-977 |
0.64 |
Cl.NCC(C1CC1)c1ccccc1 |
|
| MCULE-3895008072 |
0.64 |
[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@H](CC2=O)C2=CC=C(C=C2)O)C=1)CO |
|
| MolPort-028-610-244 |
0.64 |
CC(C)(CO)[C@H](N)c1ccccc1 |
|
| MCULE-6542351856 |
0.64 |
C12C(O)=CC(=CC=1OC1(CC2=O)CCCCC1)O |
|
| MolPort-023-334-181 |
0.64 |
OCc1ccccc1C1CC1 |
|
| MCULE-8468757536 |
0.64 |
O(C1C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1)C1C(O)C(C(CO1)O)O |
|
| MolPort-046-660-985 |
0.64 |
C[C@H](N)C1(CC1(C)C)c1ccccc1 |
|
| MCULE-3818653032 |
0.64 |
C12=CC(O)=CC=C1OC(CC2=O)(C)C |
|
| MolPort-000-861-639 |
0.64 |
Cl.CC(C)CC(N)Cc1ccccc1 |
|
| MCULE-3600472837 |
0.64 |
C1(O)C=C2OC(C3C=CC(=CC=3)OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O)C3O)CC(=O)C2=CC=1 |
|
| MolPort-046-656-992 |
0.64 |
CC(N)C1(CC1(C)C)c1ccccc1 |
|
| MCULE-1153375655 |
0.64 |
OC1C=CC(=CC=1OC)C1OC2C(=C(C=C(O[C@H]3[C@H](O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@@H](COC(CC(C)(O)CC(=O)O)=O)O3)C=2)O)C(=O)C1 |
|
| MolPort-046-690-118 |
0.64 |
Cl.CC(C)(Cc1ccccc1)NO |
|
| MCULE-3980393912 |
0.64 |
C1(C)(CC(C)(C)C2=C(C=C(C=C2)O)O1)C1=CC=C(C=C1O)O |
|
| MolPort-044-195-475 |
0.64 |
Cl.CC1(C)CC1(CN)c1ccccc1 |
|
| MCULE-7065456974 |
0.64 |
C1(OC2OC(C)C(C(O)C2O)O)C(O)C(O)C(OC1OC1C=C(O)C2=C(OC(CC2=O)C2=CC=C(C=C2)O)C=1)CO |
|
| MolPort-000-139-913 |
0.64 |
NC1Cc2ccccc2C1 |
|
| MCULE-9330611865 |
0.64 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1 |
|
| MolPort-001-767-549 |
0.64 |
NC(C(N)c1ccccc1)c1ccccc1 |
|
| MCULE-1916199374 |
0.64 |
C12OC3COC4=C(C=C(C(OC)=C4)OC)C3C(=O)C=1C=CC1=C2CC(O1)C(C)=O |
|
| MolPort-046-651-895 |
0.64 |
C[C@@H](N)C1(CC1(C)C)c1ccccc1 |
|
| MCULE-8365548043 |
0.64 |
C1C(=O)C2C=CC(O)=CC=2O[C@@H]1C1C=CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)=CC=1 |
|
| MolPort-046-701-757 |
0.64 |
N[C@@H]([C@H](N)c1ccccc1)c1ccccc1.N[C@H]([C@@H](N)c1ccccc1)c1ccccc1 |
|
| MCULE-8829778800 |
0.64 |
C1(C2=CC=CC=C2C(O)=O)CC(=O)C2=C(C=CC=C2)O1 |
|
| MolPort-042-684-042 |
0.64 |
CC1(C)[C@@H](N)[C@@H]1c1ccccc1 |
|
| MCULE-7194407469 |
0.64 |
CC1OC(OCC2OC(OC3C=C4C(C(CC(C5C=CC(O)=CC=5)O4)=O)=C(O)C=3)C(O)C(O)C2O)C(O)C(O)C1O |
|
| MolPort-000-698-633 |
0.64 |
Cl.NC(Cc1ccccc1)c1ccccc1 |
|
| MCULE-8755204723 |
0.64 |
[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@@H](CC2=O)C2=CC=C(C=C2)O)C=1)CO |
|
| MolPort-003-931-208 |
0.64 |
C[C@@H](O)c1cccc2ccccc12 |
|
| MCULE-2687134924 |
0.64 |
C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC(Cl)=CC=1Cl |
|
| MolPort-022-657-332 |
0.64 |
CC(O)(CN)c1cccc(F)c1 |
|
| MolPort-006-418-560 |
0.64 |
CC(C)(O)c1ccc2ccccc2c1 |
|
| MolPort-042-605-904 |
0.64 |
CC(C)C(NCC#C)C(O)c1ccccc1 |
|
| MolPort-003-981-975 |
0.64 |
CC[C@H](N)c1ccc(C)c(C)c1 |
|
| MolPort-008-644-217 |
0.64 |
Cc1ccccc1C(O)C1CC1 |
|
| MolPort-024-818-790 |
0.64 |
NC(CO)C(O)c1ccc(F)c(F)c1 |
|
| MolPort-046-147-391 |
0.64 |
Cl.COc1cccc(c1)C(O)C(C)N |
|
| MolPort-046-653-942 |
0.64 |
CC(C)(C)C1(CO1)c1ccccc1 |
|
| MolPort-001-764-875 |
0.64 |
CC(C)CC(C)(C)C(C)(O)c1cccc(C)c1 |
|
| MolPort-001-785-805 |
0.64 |
OC(Cc1ccccc1)(c1ccccc1)c1ccccc1 |
|
| MolPort-033-425-141 |
0.64 |
CCCc1ccc(cc1)C(O)CC=C |
|
| MolPort-004-322-755 |
0.64 |
CC(N)Cc1ccccc1O |
|
| MolPort-013-676-598 |
0.64 |
CC(C)c1ccc(cc1)C(O)CC=C |
|
| MolPort-035-777-813 |
0.64 |
COCc1ccc(CC(C)(C)O)cc1 |
|
| MolPort-001-835-584 |
0.64 |
OC(C1CC1)(c1ccccc1)c1ccccc1 |
|
| MolPort-000-001-023 |
0.64 |
NCC1(O)CCCc2ccccc12 |
|
| MolPort-009-067-774 |
0.64 |
CCCCCC(O)c1ccccc1 |
|
| MolPort-011-835-894 |
0.64 |
OC(CC(F)(F)F)c1ccccc1 |
|
| MolPort-013-577-388 |
0.64 |
CNC(Cc1ccc(C)cc1)Cc1ccc(C)cc1 |
|
| MolPort-002-498-506 |
0.64 |
CCc1ccc(cc1)C(O)CC=C |
|
| MolPort-046-510-576 |
0.64 |
OC(CC(F)F)c1ccccc1 |
|
| MolPort-011-910-906 |
0.64 |
Cc1ccccc1C(C)(O)C1CC1 |
|
| MolPort-013-998-046 |
0.64 |
CCC(O)c1ccc(cc1)-c1ccccc1 |
|
| MolPort-044-623-109 |
0.64 |
Cl.N[C@H](CO)CCc1ccccc1 |
|
| MolPort-035-778-987 |
0.64 |
CC(C)c1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-044-586-789 |
0.64 |
Cl.CC(C)(N)Cc1ccc(cc1)C#N |
|
| MolPort-035-781-323 |
0.64 |
CC(C)(C)c1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-004-793-119 |
0.64 |
CC(C)C1(CO1)c1ccccc1 |
|
| MolPort-044-196-603 |
0.64 |
N[C@@H]1CCO[C@H]1c1ccccc1 |
|
| MolPort-016-636-558 |
0.64 |
Cl.CCC(N)(CO)c1ccccc1 |
|
| MolPort-027-845-653 |
0.64 |
OCc1ccc(cc1)C1(CC1)C#N |
|
| MolPort-002-054-166 |
0.64 |
Cc1ccc(cc1)C(N)CCO |
|
| MolPort-044-623-112 |
0.64 |
Cl.N[C@@H](CO)CCc1ccccc1 |
|
| MolPort-002-054-167 |
0.64 |
CC(C)c1ccc(cc1)C(N)CCO |
|
| MolPort-027-355-674 |
0.64 |
CC(C)Cc1ccc(cc1)C(O)CC=C |
|
| MolPort-027-355-668 |
0.64 |
CC(C)(C)c1ccc(cc1)C(O)CC=C |
|
| MolPort-016-633-943 |
0.64 |
Cl.CC(N)Cc1ccc(cc1)-c1ccccc1 |
|
| MolPort-000-163-802 |
0.64 |
CCC(N)c1ccc(C)c(C)c1 |
|
| MolPort-012-949-208 |
0.64 |
Cc1ccc(cc1C)C(C)(O)C1CC1 |
|
| MolPort-009-766-218 |
0.64 |
Cl.CC(C)Cc1ccc(cc1)C(C)C(N)=N |
|
| MolPort-002-501-566 |
0.64 |
Cc1ccc(cc1)[C@H](N)CCO |
|
| MolPort-002-498-504 |
0.64 |
Cc1cc(C)cc(c1)C(O)CC=C |
|
| MolPort-005-980-703 |
0.64 |
CC(C)(O)c1ccc2cc(ccc2c1)C(C)(C)O |
|
| MolPort-006-704-389 |
0.64 |
Cl.Cc1ccc(cc1)C1(O)CCNC1 |
|
| MolPort-023-331-183 |
0.64 |
Cl.NCC(O)c1cccc(Br)c1 |
|
| MolPort-022-657-309 |
0.64 |
CC(O)(CN)c1cccc(Cl)c1 |
|
| MolPort-038-949-655 |
0.64 |
Cl.Cc1cc(CC(C)(C)N)ccc1Br |
|
| MolPort-035-789-541 |
0.64 |
Cl.NC[C@H](O)c1cccc(Br)c1 |
|
| MolPort-004-289-019 |
0.64 |
NCC(O)c1cccc(F)c1 |
|
| MolPort-030-004-787 |
0.64 |
OC(=O)C(F)(F)F.OC1(CNC1)c1ccccc1 |
|
| MolPort-020-121-884 |
0.64 |
Cl.CC(C)(C)CNCC(O)c1ccccc1 |
|
| MolPort-002-051-620 |
0.64 |
OC(CN=[N+]=[N-])c1ccccc1 |
|
| MolPort-001-797-317 |
0.64 |
CC(O)c1ccc2cc3ccccc3cc2c1 |
|
| MolPort-003-178-884 |
0.64 |
NCCc1ccc2ccccc2c1 |
|
| MolPort-023-278-719 |
0.64 |
Cl.CC(CN)c1ccccc1 |
|
| MolPort-001-793-657 |
0.64 |
C[C@@H](O)c1ccc2ccccc2c1 |
|
| MolPort-022-523-122 |
0.64 |
CC(C)(CN)c1ccc2ccccc2c1 |
|
| MolPort-001-794-086 |
0.64 |
NCCc1cccc2ccccc12 |
|
| MolPort-001-793-118 |
0.64 |
C[C@H](O)c1ccc2ccccc2c1 |
|
| MolPort-046-654-816 |
0.64 |
C[C@H](CN)c1ccc2ccccc2c1 |
|
| MolPort-020-003-548 |
0.64 |
Cl.C[C@@H](CN)c1ccccc1 |
|
| MolPort-006-122-717 |
0.64 |
C[C@H](N)Cc1cccc(c1)C(F)(F)F |
|
| MolPort-035-831-232 |
0.64 |
Cl.NC[C@@H](O)c1cccc(Br)c1 |
|
| MolPort-031-201-066 |
0.64 |
NC[C@H](O)c1cccc(c1)C#N |
|
| MolPort-001-011-878 |
0.64 |
NC(=O)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-020-180-901 |
0.64 |
Cl.CC(C(O)c1ccc2ccccc2c1)N1CCCCC1 |
|
| MolPort-005-942-892 |
0.64 |
OCc1ccc2CCc2c1 |
|
| MolPort-042-605-775 |
0.64 |
Cl.NCCc1ccc(cc1)C1CCCCC1 |
|
| MolPort-042-621-934 |
0.64 |
Cl.CC(N)Cc1ccc(cc1)C#N |
|
| MolPort-020-168-378 |
0.64 |
Cl.CCC(N)C(O)c1c(F)cccc1F |
|
| MolPort-027-138-918 |
0.64 |
CCC(O)c1cccc(COC)c1 |
|
| MolPort-046-588-884 |
0.64 |
[Cl-].CC([NH3+])Cc1ccc(cc1)-c1ccccc1 |
|
| MolPort-013-291-121 |
0.64 |
Cc1cccc(c1)C1(CN)CCCCC1 |
|
| MolPort-000-163-135 |
0.64 |
NCC(CC(O)=O)c1ccccc1 |
|
| MolPort-027-836-785 |
0.64 |
Cl.NC[C@@H](O)c1cccc(Cl)c1 |
|
| MolPort-035-680-421 |
0.64 |
Cl.NC[C@H](O)c1cccc(Cl)c1 |
|
| MolPort-003-748-961 |
0.64 |
NCC(O)c1cccc(Cl)c1 |
|
| MolPort-046-690-473 |
0.64 |
Cl.CC(C)NCC(O)c1ccc(C)cc1 |
|
| MolPort-000-000-927 |
0.64 |
Cl.NCC(O)c1cccc(Cl)c1 |
|
| MolPort-027-721-583 |
0.64 |
OC(=O)C(O)=O.CC(N)C(c1ccccc1)c1ccccc1 |
|
| MolPort-035-789-419 |
0.64 |
Cl.Cc1ccccc1C1(O)CNC1 |
|
| MolPort-014-213-944 |
0.64 |
OC(CCC#C)c1ccccc1 |
|
| MolPort-024-468-849 |
0.64 |
CCc1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-046-659-623 |
0.64 |
CCc1ccc(cc1)C(C)[C@@H](C)CN |
|
| MolPort-020-915-630 |
0.64 |
CC(C)c1ccc(CC(C)(C)O)cc1 |
|
| MolPort-046-662-043 |
0.64 |
C[C@@H](CN)C(C)c1ccc(C)cc1 |
|
| MolPort-046-651-381 |
0.64 |
C[C@@H](CN)Cc1ccc(cc1)C(C)C |
|
| MolPort-023-049-431 |
0.64 |
CC(C)Cc1ccc(CC(C)(C)O)cc1 |
|
| MolPort-023-048-150 |
0.64 |
CCCc1ccc(CC(C)(C)O)cc1 |
|
| MolPort-035-782-175 |
0.64 |
CCCc1ccc(CC(C)O)cc1 |
|
| MolPort-046-652-278 |
0.64 |
CC(C)c1ccc(cc1)C(C)[C@@H](C)CN |
|
| MolPort-035-782-185 |
0.64 |
CC(C)Cc1ccc(CC(C)O)cc1 |
|
| MolPort-035-781-323 |
0.64 |
CC(C)(C)c1cccc(c1)C(C)(O)C1CC1 |
|
| MolPort-046-661-284 |
0.64 |
C[C@@H](CN)Cc1ccc(cc1)C(C)(C)C |
|
| MolPort-046-658-066 |
0.64 |
C[C@H](CN)C(C)c1ccc(C)cc1 |
|
| MolPort-046-657-672 |
0.64 |
CC(C)c1ccc(cc1)C(C)[C@H](C)CN |
|
| MolPort-046-666-308 |
0.64 |
CCc1ccc(C[C@H](C)CN)cc1 |
|
| MolPort-046-657-671 |
0.64 |
CCc1ccc(cc1)C(C)[C@H](C)CN |
|
| MolPort-046-666-320 |
0.64 |
C[C@H](CN)Cc1ccc(cc1)C(C)C |
|
| MolPort-035-789-399 |
0.64 |
CC1(C)[C@H](N)[C@H]1c1ccccc1 |
|
| MolPort-046-660-985 |
0.64 |
C[C@H](N)C1(CC1(C)C)c1ccccc1 |
|
| MolPort-021-783-768 |
0.64 |
Cl.CC[C@@H](N)c1cccc(C)c1 |
|
| MolPort-023-334-181 |
0.64 |
OCc1ccccc1C1CC1 |
|
| MolPort-046-651-895 |
0.64 |
C[C@@H](N)C1(CC1(C)C)c1ccccc1 |
|
| MolPort-046-656-992 |
0.64 |
CC(N)C1(CC1(C)C)c1ccccc1 |
|
| MolPort-046-701-757 |
0.64 |
N[C@@H]([C@H](N)c1ccccc1)c1ccccc1.N[C@H]([C@@H](N)c1ccccc1)c1ccccc1 |
|
| MolPort-042-684-042 |
0.64 |
CC1(C)[C@@H](N)[C@@H]1c1ccccc1 |
|
| MolPort-020-093-500 |
0.64 |
NC1CCC1c1ccccc1 |
|
| MolPort-028-610-245 |
0.64 |
CC(C)(CO)[C@@H](N)c1ccccc1 |
|
| MolPort-028-957-599 |
0.64 |
Cl.NCC1(CCC1)c1ccccc1 |
|
| MolPort-044-195-475 |
0.64 |
Cl.CC1(C)CC1(CN)c1ccccc1 |
|
| MolPort-046-690-118 |
0.64 |
Cl.CC(C)(Cc1ccccc1)NO |
|
| MolPort-044-878-292 |
0.64 |
Cl.CCC(N)c1cc(C)cc(C)c1 |
|
| MolPort-045-971-481 |
0.64 |
Cl.Cl.CC(Cc1ccccc1)NN |
|
| MolPort-038-949-977 |
0.64 |
Cl.NCC(C1CC1)c1ccccc1 |
|
| MolPort-028-610-244 |
0.64 |
CC(C)(CO)[C@H](N)c1ccccc1 |
|
| MolPort-046-661-700 |
0.64 |
C[C@@H](CN)Cc1ccc(C)cc1 |
|
| MolPort-046-666-319 |
0.64 |
C[C@H](CN)Cc1ccc(C)cc1 |
|
| MolPort-027-845-653 |
0.64 |
OCc1ccc(cc1)C1(CC1)C#N |
|
| MolPort-035-789-541 |
0.64 |
Cl.NC[C@H](O)c1cccc(Br)c1 |
|
| MolPort-046-147-391 |
0.64 |
Cl.COc1cccc(c1)C(O)C(C)N |
|
| MolPort-027-138-918 |
0.64 |
CCC(O)c1cccc(COC)c1 |
|
| MolPort-044-196-603 |
0.64 |
N[C@@H]1CCO[C@H]1c1ccccc1 |
|
| MolPort-033-425-141 |
0.64 |
CCCc1ccc(cc1)C(O)CC=C |
|
| MolPort-035-777-813 |
0.64 |
COCc1ccc(CC(C)(C)O)cc1 |
|
| MolPort-027-355-674 |
0.64 |
CC(C)Cc1ccc(cc1)C(O)CC=C |
|
| MolPort-046-653-942 |
0.64 |
CC(C)(C)C1(CO1)c1ccccc1 |
|
| MolPort-027-355-668 |
0.64 |
CC(C)(C)c1ccc(cc1)C(O)CC=C |
|
| MolPort-023-331-183 |
0.64 |
Cl.NCC(O)c1cccc(Br)c1 |
|
| MolPort-035-680-421 |
0.64 |
Cl.NC[C@H](O)c1cccc(Cl)c1 |
|
| MolPort-020-167-416 |
0.63 |
Cl.NC(Cc1ccccc1)C1CC1 |
|
| MolPort-046-687-973 |
0.63 |
Cl.CC1C(N)C1c1ccccc1 |
|
| MolPort-035-801-454 |
0.63 |
CC(C)NC(C)Cc1cccc2ccccc12 |
|
| MolPort-046-676-628 |
0.63 |
Cl.C[C@@H]1C[C@@]1(N)Cc1ccccc1 |
|
| MolPort-022-369-479 |
0.63 |
NCC(CC=C)c1ccccc1 |
|
| MolPort-046-672-500 |
0.63 |
Cc1cccc(c1)C12CC(N)(C1)C2 |
|
| MolPort-046-676-089 |
0.63 |
Cc1cc(C)cc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-035-774-998 |
0.63 |
Cl.NC1CCC1c1ccccc1 |
|
| MolPort-039-241-451 |
0.63 |
Cl.CCC1(CNC1)c1ccccc1 |
|
| MolPort-046-677-021 |
0.63 |
Cc1cc(C)cc(c1)C12CC(N)(C1)C2 |
|
| MolPort-046-673-040 |
0.63 |
Cl.CC1(C)CC1(N)Cc1ccccc1 |
|
| MolPort-038-950-207 |
0.63 |
Cl.C[C@@]1(N)C[C@H]1c1ccccc1 |
|
| MolPort-023-232-433 |
0.63 |
Cl.NC1(Cc2ccccc2)CCC1 |
|
| MolPort-020-033-063 |
0.63 |
CC(C)Cc1ccc(cc1)C(O)CN1CCN(CC(C)O)CC1 |
|
| MolPort-046-678-525 |
0.63 |
Cc1cccc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-020-015-476 |
0.63 |
CCCCCCCCc1ccc(CO)cc1 |
|
| MolPort-042-604-524 |
0.63 |
Cl.N[C@@H]1CC[C@@H]1c1ccccc1 |
|
| MolPort-044-876-217 |
0.63 |
Cl.CCCc1ccccc1CCN |
|
| MolPort-039-241-793 |
0.63 |
Cl.CC(C)C1(CNC1)c1ccccc1 |
|
| MolPort-021-878-222 |
0.63 |
OCc1ccc(cc1)C1CCCC1 |
|
| MolPort-030-004-957 |
0.63 |
OCc1ccc(CCC#C)cc1 |
|
| MolPort-044-855-989 |
0.63 |
Cl.CC(N)C1(CCC1)c1ccccc1 |
|
| MolPort-021-802-431 |
0.63 |
CC(=O)c1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-028-744-908 |
0.63 |
CCCCCCCCc1ccc(cc1)C(O)CC(N)(CO)CO |
|
| MolPort-035-774-998 |
0.63 |
Cl.NC1CCC1c1ccccc1 |
|
| MolPort-014-941-112 |
0.63 |
CC(Cc1ccccc1)NCCc1ccccc1 |
|
| MolPort-023-076-405 |
0.63 |
CC(C)Cc1ccc(cc1)C(O)CN1CCN(CCO)CC1 |
|
| MolPort-046-650-698 |
0.63 |
C[C@H](CO)Cc1cccc(C)c1 |
|
| MolPort-044-729-663 |
0.63 |
Cl.COCc1ccc(cc1)C(CN)CC(O)=O |
|
| MolPort-046-655-155 |
0.63 |
C[C@H](CN)C(C)(C)c1ccccc1 |
|
| MolPort-020-915-748 |
0.63 |
Cc1cc(C)c(CCN)cc1C |
|
| MolPort-044-649-366 |
0.63 |
Cl.N[C@H](CO)Cc1cccc(Cl)c1 |
|
| MolPort-046-430-952 |
0.63 |
CC(N[C@H](CO)Cc1ccccc1)C(C)(C)O |
|
| MolPort-035-935-979 |
0.63 |
NCC(O)(CO)c1ccc(Br)cc1 |
|
| MolPort-027-806-974 |
0.63 |
Cl.N[C@@H](Cc1ccccc1)[C@H](O)CCl |
|
| MolPort-027-353-682 |
0.63 |
NCC(CCO)c1ccc(cc1)C(F)(F)F |
|
| MolPort-030-084-209 |
0.63 |
N[C@H](CO)Cc1ccccc1F |
|
| MolPort-026-048-755 |
0.63 |
NCC(CC(O)=O)c1ccc(cc1)C1CC1 |
|
| MolPort-020-916-006 |
0.63 |
NC(CO)Cc1cccc(F)c1 |
|
| MolPort-029-917-931 |
0.63 |
CC[C@@H](O)CNC(C)C(C)c1ccccc1 |
|
| MolPort-029-917-929 |
0.63 |
CCC(O)CNC(C)C(C)c1ccccc1 |
|
| MolPort-035-935-977 |
0.63 |
NCC(O)(C(O)=O)c1ccccc1 |
|
| MolPort-028-952-081 |
0.63 |
NC(Cc1ccccc1)C(O)C(F)F |
|
| MolPort-042-682-888 |
0.63 |
N[C@H](CO)Cc1cccc(F)c1 |
|
| MolPort-029-080-924 |
0.63 |
CC(C)(O)C(C)(C)c1ccccc1 |
|
| MolPort-046-654-240 |
0.63 |
C[C@@H](CO)Cc1cccc2ccccc12 |
|
| MolPort-046-654-539 |
0.63 |
C[C@H](CN)C(C)c1ccccc1 |
|
| MolPort-046-654-511 |
0.63 |
C[C@@H](CO)Cc1cc(C)cc(C)c1 |
|
| MolPort-046-651-370 |
0.63 |
C[C@@H](CN)C(C)c1ccccc1 |
|
| MolPort-046-651-351 |
0.63 |
C[C@H](CO)Cc1cc(C)cc(C)c1 |
|
| MolPort-046-657-812 |
0.63 |
C[C@@H](CN)C(C)(C)c1ccccc1 |
|
| MolPort-046-668-836 |
0.63 |
C[C@@H](CO)Cc1cccc(C)c1 |
|
| MolPort-039-240-890 |
0.63 |
CC(c1ccccc1)C(C)(C)O |
|
| MolPort-046-651-038 |
0.63 |
C[C@H](CO)Cc1ccc2ccccc2c1 |
|
| MolPort-046-651-033 |
0.63 |
C[C@H](CO)Cc1cccc2ccccc12 |
|
| MolPort-046-654-245 |
0.63 |
C[C@@H](CO)Cc1ccc2ccccc2c1 |
|
| MolPort-002-501-499 |
0.63 |
C([C@H]1CN1)c1ccccc1 |
|
| MolPort-014-943-460 |
0.63 |
CC(Cc1ccccc1)NC(C)Cc1ccccc1 |
|
| MolPort-002-679-118 |
0.63 |
CC(CCN)c1ccccc1 |
|
| MolPort-039-240-890 |
0.63 |
CC(c1ccccc1)C(C)(C)O |
|
| MolPort-006-013-193 |
0.63 |
CC(C)(CCN)c1ccccc1 |
|
| MolPort-001-793-253 |
0.63 |
CC(C)(O)Cc1ccccc1 |
|
| MolPort-046-651-038 |
0.63 |
C[C@H](CO)Cc1ccc2ccccc2c1 |
|
| MolPort-046-651-033 |
0.63 |
C[C@H](CO)Cc1cccc2ccccc12 |
|
| MolPort-029-080-924 |
0.63 |
CC(C)(O)C(C)(C)c1ccccc1 |
|
| MolPort-046-650-698 |
0.63 |
C[C@H](CO)Cc1cccc(C)c1 |
|
| MolPort-046-651-351 |
0.63 |
C[C@H](CO)Cc1cc(C)cc(C)c1 |
|
| MolPort-046-654-240 |
0.63 |
C[C@@H](CO)Cc1cccc2ccccc12 |
|
| MolPort-009-681-274 |
0.63 |
OCCCc1ccc2ccccc2c1 |
|
| MolPort-046-668-836 |
0.63 |
C[C@@H](CO)Cc1cccc(C)c1 |
|
| MolPort-008-494-172 |
0.63 |
Cc1cccc(CCCO)c1 |
|
| MolPort-003-939-071 |
0.63 |
C[C@@H](O)Cc1ccccc1 |
|
| MolPort-046-654-245 |
0.63 |
C[C@@H](CO)Cc1ccc2ccccc2c1 |
|
| MolPort-001-770-202 |
0.63 |
CC(O)Cc1ccccc1 |
|
| MolPort-046-651-370 |
0.63 |
C[C@@H](CN)C(C)c1ccccc1 |
|
| MolPort-020-915-748 |
0.63 |
Cc1cc(C)c(CCN)cc1C |
|
| MolPort-021-878-222 |
0.63 |
OCc1ccc(cc1)C1CCCC1 |
|
| MolPort-004-754-851 |
0.63 |
CC1(N)Cc2ccccc2C1 |
|
| MolPort-012-628-604 |
0.63 |
CC(C)(N)Cc1ccc(Br)cc1 |
|
| MolPort-044-876-217 |
0.63 |
Cl.CCCc1ccccc1CCN |
|
| MolPort-020-167-416 |
0.63 |
Cl.NC(Cc1ccccc1)C1CC1 |
|
| MolPort-030-004-957 |
0.63 |
OCc1ccc(CCC#C)cc1 |
|
| MolPort-020-015-476 |
0.63 |
CCCCCCCCc1ccc(CO)cc1 |
|
| MolPort-001-767-522 |
0.63 |
Cl.NC1Cc2ccccc2C1 |
|
| MolPort-008-752-208 |
0.63 |
Cc1cccc(CC(C)(C)CO)c1 |
|
| MolPort-020-033-063 |
0.63 |
CC(C)Cc1ccc(cc1)C(O)CN1CCN(CC(C)O)CC1 |
|
| MolPort-023-076-405 |
0.63 |
CC(C)Cc1ccc(cc1)C(O)CN1CCN(CCO)CC1 |
|
| MolPort-044-729-663 |
0.63 |
Cl.COCc1ccc(cc1)C(CN)CC(O)=O |
|
| MolPort-005-310-727 |
0.63 |
Cl.NCCc1ccc(cc1)C(O)=O |
|
| MolPort-004-291-051 |
0.63 |
CCC(O)c1cccc(Br)c1 |
|
| MolPort-013-383-012 |
0.63 |
OC1(CC1)c1ccccc1Br |
|
| MolPort-046-655-155 |
0.63 |
C[C@H](CN)C(C)(C)c1ccccc1 |
|
| MolPort-003-891-538 |
0.63 |
OCC(CO)Cc1ccccc1 |
|
| MCULE-1954398259 |
0.63 |
OC1C=CC(C2OC3=CC(=C([C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)O4)C(O)=C3C(=O)C2)O)=CC=1 |
|
| MolPort-046-657-812 |
0.63 |
C[C@@H](CN)C(C)(C)c1ccccc1 |
|
| MCULE-9072285894 |
0.63 |
O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C+]1CC2C(=CC(=CC=2OC1C1C=C(O)C(O)=CC=1)O)O |
|
| MolPort-044-649-366 |
0.63 |
Cl.N[C@H](CO)Cc1cccc(Cl)c1 |
|
| MCULE-4132938823 |
0.63 |
C1C(O)=C2CC(O)C(C3C=CC(O)=CC=3)OC2=C2C3(OC4C=C(O)C(C5C(O)C(O)C(O)C(CO)O5)=C(O)C=4C3=O)C(C3C=CC(O)=CC=3)OC=12 |
|
| MolPort-030-084-209 |
0.63 |
N[C@H](CO)Cc1ccccc1F |
|
| MCULE-8133441488 |
0.63 |
C1(O)C=C2O[C@]3(OC4C([C@H]([C@@H]3O)C2=C(O)C=1)=C1O[C@H](C2C=CC(O)=CC=2)[C@@H](O)[C@H](C2C(O)=CC(O)=C3C[C@H](O)[C@@H](C5C=CC(O)=CC=5)OC3=2)C1=C(O)C=4)C1C=CC(O)=CC=1 |
|
| MolPort-035-935-977 |
0.63 |
NCC(O)(C(O)=O)c1ccccc1 |
|
| MCULE-7803942227 |
0.63 |
CC1=CC2C(=O)CC(C)(C)OC=2C=C1 |
|
| MolPort-008-465-911 |
0.63 |
NC(CO)Cc1cccc(Cl)c1 |
|
| MCULE-3688085298 |
0.63 |
CC1C=C2C(=O)CC3(COC3)OC2=CC=1 |
|
| MolPort-029-917-929 |
0.63 |
CCC(O)CNC(C)C(C)c1ccccc1 |
|
| MCULE-6373579877 |
0.63 |
C1(O)C=C2OCC(C3C=CC(O)=C(OC)C=3OC)C(=O)C2=C(O)C=1 |
|
| MolPort-001-758-819 |
0.63 |
N[C@@H](C(c1ccccc1)c1ccccc1)C(O)=O |
|
| MCULE-9126215246 |
0.63 |
O=C1CCOC2=C1C=CC(O)=C2C |
|
| MolPort-009-680-905 |
0.63 |
NC(C(c1ccccc1)c1ccccc1)C(O)=O |
|
| MCULE-1897206983 |
0.63 |
C12C=C(O)C=CC=1C(CC1(CCCC(C)C1)O2)=O |
|
| MolPort-020-916-006 |
0.63 |
NC(CO)Cc1cccc(F)c1 |
|
| MCULE-7719029273 |
0.63 |
ClC1=CC2=C(OC(C3=CC=CC=C3)CC2=O)C(Cl)=C1 |
|
| MolPort-046-654-539 |
0.63 |
C[C@H](CN)C(C)c1ccccc1 |
|
| MCULE-7008971924 |
0.63 |
C1(=O)C(C=O)C(C)(C)OC2=CC=C(OC)C=C12 |
|
| MolPort-027-353-682 |
0.63 |
NCC(CCO)c1ccc(cc1)C(F)(F)F |
|
| MCULE-1518526020 |
0.63 |
C1(C(=O)C2C=CC3=C(OCCO3)C=2)C(O1)C1C=C(OC)C(=C(OC)C=1)OC |
|
| MolPort-003-803-318 |
0.63 |
CC(CN(C)C)C(O)(c1ccccc1)c1ccccc1 |
|
| MCULE-3974580137 |
0.63 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)CC2=C(O)C=1 |
|
| MolPort-042-682-888 |
0.63 |
N[C@H](CO)Cc1cccc(F)c1 |
|
| MCULE-9023136064 |
0.63 |
C12=C(Br)C=C(C=C1C(CC(C1=CC=C(C=C1)C(O)=O)O2)=O)Br |
|
| MolPort-046-430-952 |
0.63 |
CC(N[C@H](CO)Cc1ccccc1)C(C)(C)O |
|
| MCULE-7916081306 |
0.63 |
C12=CC(=CC=C1OCC(C(=O)C)C2=O)C |
|
| MolPort-009-757-680 |
0.63 |
Cl.Cl.NC(Cc1cccc(CC(N)C(O)=O)c1)C(O)=O |
|
| MCULE-7991718746 |
0.63 |
O(C1C=C2O[C@H](C3C=CC(O)=CC=3)[C@]([H])(C(=O)C2=C(O)C=1)[C@]1([H])[C@@H](C2C=CC(O)=CC=2)OC2C(=C(C=C(C=2)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O)C1=O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
|
| MolPort-027-806-974 |
0.63 |
Cl.N[C@@H](Cc1ccccc1)[C@H](O)CCl |
|
| MCULE-5901955895 |
0.63 |
O(C1C(C2C=CC(O)=C(O)C=2)OC2C(=C(C=C(O)C=2)O)C1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
|
| MolPort-002-472-794 |
0.63 |
NC(Cc1ccccc1)C(O)C(F)(F)F |
|
| MCULE-5799382905 |
0.63 |
COC1=CC=C(C2OC3=C(C=C(N(=O)=O)C=C3)C(=O)C2)C=C1 |
|
| MolPort-029-917-931 |
0.63 |
CC[C@@H](O)CNC(C)C(C)c1ccccc1 |
|
| MCULE-7109597807 |
0.63 |
C12C(O)=CC(=C(C/C=C(/C)\C)C=1OC(C1C=CC(=CC=1)O)C(O)C2=O)OC1OC(CO)C(C(O)C1O)O |
|
| MolPort-008-465-904 |
0.63 |
NC(CO)Cc1ccccc1F |
|
| MCULE-6863370760 |
0.63 |
C12C=C(O)C=CC=1C(CC1(CCCCC1)O2)=O |
|
| MolPort-001-758-820 |
0.63 |
N[C@H](C(c1ccccc1)c1ccccc1)C(O)=O |
|
| MCULE-8328465292 |
0.63 |
C1=C(O)C=C2C=C3C(=C(C2=C1OC)O)C(=O)CC(O)(C)O3 |
|
| MolPort-008-465-910 |
0.63 |
NC(CO)Cc1ccccc1Cl |
|
| MCULE-1479570353 |
0.63 |
OC1C=CC([C@H]2OC3C(C([C@@H]2O)=O)=C(C=C(C=3C/C=C(\C)/C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O)=CC=1 |
|
| MolPort-035-935-979 |
0.63 |
NCC(O)(CO)c1ccc(Br)cc1 |
|
| MCULE-3353878822 |
0.63 |
C1(CC(=O)C2=C(C=CC(C)=C2)O1)C1C=CC(=CC=1Cl)Cl |
|
| MolPort-026-048-755 |
0.63 |
NCC(CC(O)=O)c1ccc(cc1)C1CC1 |
|
| MCULE-6609850631 |
0.63 |
C12C(=O)CC(OC=1C=C1C(C(O)=CC(O)=C1C1=C(O)C=C(C3=C(C4C(CC(C)OC=4C=C31)=O)O)O)=C2O)C |
|
| MolPort-008-482-930 |
0.63 |
NCCC(O)c1ccc(F)cc1 |
|
| MCULE-9004299901 |
0.63 |
O1C(C2C=CC(=CC=2)C)CC(C2C=CC=C(Cl)C1=2)=O |
|
| MolPort-000-744-360 |
0.63 |
[Cl-].[Cl-].[NH3+]C(Cc1cccc(CC([NH3+])C(O)=O)c1)C(O)=O |
|
| MCULE-4398219856 |
0.63 |
C12C=C(O)C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O |
|
| MolPort-000-710-230 |
0.63 |
CN(C)CCC(O)(c1ccccc1)c1ccccc1 |
|
| MCULE-6209795779 |
0.63 |
C12=C(C)C=C(C=C1OC(CC2=O)(C)C)OC(C(OCC)=O)C(OCC)=O |
|
| MolPort-002-113-431 |
0.63 |
Cl.Cc1ccc(cc1)C(CN)CC(O)=O |
|
| MCULE-7823125252 |
0.63 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OCC(O)=O)=O |
|
| MolPort-028-952-081 |
0.63 |
NC(Cc1ccccc1)C(O)C(F)F |
|
| MCULE-6147217322 |
0.63 |
C12C(O)=CC(=C(C/C=C(\C)/C)C=1O[C@H](C1=CC=C(C=C1)O)[C@@H](O)C2=O)O[C@@H]1O[C@H](CO)[C@H]([C@H](O)[C@H]1O)O |
|
| MolPort-016-635-565 |
0.63 |
NCCC(O)(c1ccccc1)C(F)(F)F |
|
| MCULE-1994873281 |
0.63 |
COC1=C2C(C(CC(O2)(C)C)=O)=CC=C1 |
|
| MolPort-046-654-511 |
0.63 |
C[C@@H](CO)Cc1cc(C)cc(C)c1 |
|
| MCULE-4912537449 |
0.63 |
C1(CO)(CC2=CC=C(C=C2)OC)COC2C(=CC=CC=2)C1=O |
|
| MolPort-001-759-236 |
0.63 |
C[C@H](O)Cc1ccccc1 |
|
| MCULE-8640026575 |
0.63 |
C12C=CC(=CC=1OCCC2=O)O |
|
| MolPort-000-158-258 |
0.63 |
NCCCc1ccccc1 |
|
| MCULE-6916263915 |
0.63 |
C12C=C(O)C=CC=1C(CC1(CCC(CC1)C)O2)=O |
|
| MolPort-013-897-768 |
0.63 |
OCCCc1cccc2ccccc12 |
|
| MCULE-4124637206 |
0.63 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O2)C(O)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-023-232-433 |
0.63 |
Cl.NC1(Cc2ccccc2)CCC1 |
|
| MCULE-6524501187 |
0.63 |
N(=O)(=O)C1C=CC(=CC=1)OCC1C(OC)=CC=C(C=1)C1CC(=O)C2=C(C=CC=C2)O1 |
|
| MolPort-046-676-628 |
0.63 |
Cl.C[C@@H]1C[C@@]1(N)Cc1ccccc1 |
|
| MCULE-1908090081 |
0.63 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1 |
|
| MolPort-035-801-454 |
0.63 |
CC(C)NC(C)Cc1cccc2ccccc12 |
|
| MolPort-042-604-524 |
0.63 |
Cl.N[C@@H]1CC[C@@H]1c1ccccc1 |
|
| MolPort-046-676-089 |
0.63 |
Cc1cc(C)cc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-028-744-908 |
0.63 |
CCCCCCCCc1ccc(cc1)C(O)CC(N)(CO)CO |
|
| MolPort-021-802-431 |
0.63 |
CC(=O)c1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-003-794-876 |
0.63 |
NCc1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-046-687-973 |
0.63 |
Cl.CC1C(N)C1c1ccccc1 |
|
| MolPort-022-369-479 |
0.63 |
NCC(CC=C)c1ccccc1 |
|
| MolPort-009-013-764 |
0.63 |
Cl.N[C@@H](Cc1ccccc1)C=C |
|
| MolPort-044-855-989 |
0.63 |
Cl.CC(N)C1(CCC1)c1ccccc1 |
|
| MolPort-046-678-525 |
0.63 |
Cc1cccc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-046-677-021 |
0.63 |
Cc1cc(C)cc(c1)C12CC(N)(C1)C2 |
|
| MolPort-046-672-500 |
0.63 |
Cc1cccc(c1)C12CC(N)(C1)C2 |
|
| MolPort-046-673-040 |
0.63 |
Cl.CC1(C)CC1(N)Cc1ccccc1 |
|
| MolPort-039-241-793 |
0.63 |
Cl.CC(C)C1(CNC1)c1ccccc1 |
|
| MolPort-038-950-207 |
0.63 |
Cl.C[C@@]1(N)C[C@H]1c1ccccc1 |
|
| MolPort-039-241-451 |
0.63 |
Cl.CCC1(CNC1)c1ccccc1 |
|
| MolPort-012-782-535 |
0.62 |
COC(=O)C(N)C(C)c1ccccc1 |
|
| MolPort-022-913-077 |
0.62 |
Cc1cccc(c1)C(CN)CO |
|
| MolPort-028-766-781 |
0.62 |
Cl.CN(C)CCc1ccccc1CO |
|
| MolPort-013-382-864 |
0.62 |
OC1(CC1)c1cccc(Br)c1 |
|
| MolPort-002-469-512 |
0.62 |
CC(C)C(N)c1ccccc1 |
|
| MolPort-038-948-010 |
0.62 |
OCCCc1cccc(CCCO)c1 |
|
| MolPort-006-710-400 |
0.62 |
Cl.CC(=O)c1ccc(CC(N)C(O)=O)cc1 |
|
| MolPort-035-779-693 |
0.62 |
CC(C)(O)Cc1ccc2ccccc2c1 |
|
| MolPort-020-073-059 |
0.62 |
Cl.CC(C)(CN)Cc1ccccc1 |
|
| MolPort-001-768-196 |
0.62 |
OC[C@@H](O)c1ccccc1 |
|
| MolPort-028-599-994 |
0.62 |
Cl.CC(=O)c1ccc(C[C@H](N)C(O)=O)cc1 |
|
| MolPort-000-860-877 |
0.62 |
OC[C@H](O)c1ccccc1 |
|
| MolPort-001-793-369 |
0.62 |
CCC(CO)c1ccccc1 |
|
| MolPort-008-324-027 |
0.62 |
NCCCc1cccc2ccccc12 |
|
| MolPort-026-685-968 |
0.62 |
CC(C)(O)Cc1cccc2ccccc12 |
|
| MolPort-008-440-408 |
0.62 |
Cl.CC(CN)Cc1ccccc1 |
|
| MolPort-003-931-075 |
0.62 |
O[C@@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-002-798-924 |
0.62 |
OC(Cc1ccccc1)(c1ccccc1)c1cc2ccccc2c2ccccc12 |
|
| MolPort-022-913-786 |
0.62 |
NCC(O)CCCc1ccccc1 |
|
| MolPort-005-237-109 |
0.62 |
NCC1(CC1)c1cccc(c1)C(F)(F)F |
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| MolPort-042-620-542 |
0.62 |
CO[C@@H]1[C@H](N)Cc2ccccc12 |
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| MolPort-020-103-943 |
0.62 |
Cl.OC(CNC1CC1)c1ccccc1 |
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| MolPort-042-622-517 |
0.62 |
Cl.NCC(O)c1cccc(c1)C#N |
|
| MolPort-046-793-193 |
0.62 |
Cl.C[C@@H](N)Cc1cccc(c1)C(F)(F)F |
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| MolPort-001-684-475 |
0.62 |
CC(NCCC(O)=O)C(O)c1ccccc1 |
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| MolPort-035-782-917 |
0.62 |
Cl.CC(C)(N)Cc1cccc(c1)C(F)(F)F |
|
| MolPort-020-002-729 |
0.62 |
CNC[C@@H](O)c1ccc(O)cc1 |
|
| MolPort-044-652-172 |
0.62 |
NCC1(CCCO1)c1ccccc1 |
|
| MolPort-016-634-112 |
0.62 |
Cl.COC1(CNC1)c1ccccc1 |
|
| MolPort-046-550-224 |
0.62 |
NC[C@H](O)c1cccc(c1)-c1ccc2CCCc2c1 |
|
| MolPort-027-025-902 |
0.62 |
CCc1ccc(cc1)C(O)CN(C)CCc1ccccc1 |
|
| MolPort-035-789-752 |
0.62 |
Cl.NC[C@H](CC(O)=O)c1ccccc1 |
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| MolPort-020-039-612 |
0.62 |
CC(C)C(O)(CN1CCC(O)CC1)c1ccccc1 |
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| MolPort-023-334-317 |
0.62 |
Cl.NC1CCc2ccccc2C1O |
|
| MolPort-020-098-458 |
0.62 |
Cl.NCC(O)c1c(Cl)cccc1Cl |
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| MolPort-046-655-969 |
0.62 |
CCC([C@H](C)CO)c1ccc(C)cc1 |
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| MolPort-027-025-884 |
0.62 |
CN(CCc1ccccc1)CC(O)c1ccc(C)cc1 |
|
| MolPort-046-655-529 |
0.62 |
C[C@@H](CN)c1c(C)cc(C)cc1C |
|
| MolPort-004-313-954 |
0.62 |
Cc1cc(C)c(CCN)c(C)c1 |
|
| MolPort-000-707-094 |
0.62 |
Cl.NCC(CC(O)=O)c1ccccc1 |
|
| MolPort-046-654-846 |
0.62 |
CCC([C@@H](C)CO)c1ccc(C)cc1 |
|
| MolPort-046-148-606 |
0.62 |
Cl.NC[C@@H](O)c1cccc(F)c1 |
|
| MolPort-046-419-721 |
0.62 |
Cl.COC(=O)c1ccc(cc1)C1(CN)CC1 |
|
| MolPort-000-787-358 |
0.62 |
CNCC(O)c1ccc(O)cc1 |
|
| MolPort-035-781-372 |
0.62 |
CCCC(C)(O)c1c(C)cc(C)cc1C |
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| MolPort-000-154-858 |
0.62 |
Cc1ccc(CCN)c(C)c1 |
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| MolPort-002-859-181 |
0.62 |
CC(C)NCC(O)(c1ccccc1)c1ccccc1 |
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| MolPort-002-054-175 |
0.62 |
Cl.NCC1(O)CCCc2ccccc12 |
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| MolPort-046-702-846 |
0.62 |
Cl.C[C@H](N)Cc1cccc(c1)C(F)(F)F |
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| MolPort-006-013-332 |
0.62 |
NCC(O)c1c(Cl)cccc1Cl |
|
| MolPort-046-666-715 |
0.62 |
C[C@H](CN)c1c(C)cc(C)cc1C |
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| MolPort-020-015-948 |
0.62 |
CNC[C@H](O)c1ccc(O)cc1 |
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| MolPort-006-841-270 |
0.62 |
Cl.CC(C)(C)c1ccc(CCCN)cc1 |
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| MolPort-028-286-804 |
0.62 |
CCC(Cc1ccccc1)N(C)CC#N |
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| MolPort-004-288-532 |
0.62 |
NCC(O)c1c(F)cccc1F |
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| MolPort-028-751-591 |
0.62 |
Cl.NC[C@@H](CC(O)=O)c1ccccc1 |
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| MolPort-008-645-226 |
0.62 |
Cc1ccc(c(C)c1)C(C)(C)CN |
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| MolPort-005-124-063 |
0.62 |
CN(CCc1cccc(C)c1)CC(O)c1ccccc1 |
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| MolPort-046-481-536 |
0.62 |
C[C@H](O)CNCC(O)c1cccc2ccccc12 |
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| MolPort-035-782-907 |
0.62 |
Cl.Cc1ccc(CC(C)(C)CN)cc1 |
|
| MolPort-046-653-295 |
0.62 |
CCC(C(C)CO)c1ccc(C)cc1 |
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| MolPort-002-800-303 |
0.62 |
Cc1c(C)c(CC(C)(C)C)c(C)c(C)c1CC(C)(C)C |
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| MolPort-008-723-671 |
0.62 |
CN(C)CC(O)c1ccc(O)cc1 |
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| MolPort-002-800-569 |
0.62 |
CC(C)(C)c1ccc(cc1)C(C)(C)C(C)(C)c1cccc(c1)C(C)(C)C |
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| MolPort-035-789-446 |
0.62 |
Cl.NC[C@H](O)c1cccc(c1)C#N |
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| MolPort-035-781-372 |
0.62 |
CCCC(C)(O)c1c(C)cc(C)cc1C |
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| MolPort-013-997-581 |
0.62 |
OC(CC1CCCC1)c1ccccc1 |
|
| MolPort-027-143-079 |
0.62 |
CCCC(O)c1ccc(COC)cc1 |
|
| MolPort-003-910-770 |
0.62 |
CCC(O)c1ccc(Cl)cc1 |
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| MolPort-003-894-616 |
0.62 |
O[C@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-025-494-869 |
0.62 |
CCCC(C)(O)c1ccc(C)cc1C |
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| MolPort-011-893-359 |
0.62 |
CC(C)C(C)(O)c1ccc(Cl)cc1 |
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| MolPort-011-893-358 |
0.62 |
CCC(C)(O)c1ccc(Cl)cc1 |
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| MolPort-002-849-144 |
0.62 |
OC(CCc1ccccc1)(c1ccccc1)c1ccccc1 |
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| MolPort-012-641-569 |
0.62 |
CC(O)(CN)C(c1ccccc1)c1ccccc1 |
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| MolPort-003-801-363 |
0.62 |
O[C@H]1[C@H](O)c2cccc3cccc1c23 |
|
| MolPort-011-138-734 |
0.62 |
CC[C@H](O)c1ccc(F)cc1 |
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| MolPort-003-716-730 |
0.62 |
OC1(C2CC3CC(C2)CC1C3)c1ccccc1 |
|
| MolPort-011-892-385 |
0.62 |
CC1CCCC(O)(C1)c1ccccc1 |
|
| MolPort-000-736-158 |
0.62 |
OC(c1ccccc1)(c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
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| MolPort-002-138-178 |
0.62 |
CCC(O)(CC)c1ccccc1O |
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| MolPort-013-876-880 |
0.62 |
OC(C1CCCCCC1)c1ccccc1 |
|
| MolPort-000-004-477 |
0.62 |
OC1CCc2ccccc12 |
|
| MolPort-003-911-089 |
0.62 |
OC1(CCCCC1)c1ccccc1 |
|
| MolPort-025-494-886 |
0.62 |
CCCC(C)(O)c1cccc(C)c1C |
|
| MolPort-001-767-007 |
0.62 |
OC(C1CCCCC1)c1ccccc1 |
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| MolPort-003-930-136 |
0.62 |
O[C@@H]1CCc2ccccc12 |
|
| MolPort-023-313-632 |
0.62 |
Cl.CC(N)C(O)Cc1ccccc1 |
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| MolPort-013-899-575 |
0.62 |
Cc1ccc(cc1)C1CCCC1N |
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| MolPort-013-997-584 |
0.62 |
OC(CC1CCCCC1)c1ccccc1 |
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| MolPort-014-879-279 |
0.62 |
CCCC(C)(O)c1cc(C)ccc1C |
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| MolPort-004-321-401 |
0.62 |
CC(N)Cc1cccc(O)c1 |
|
| MolPort-004-781-989 |
0.62 |
CC[C@@H](O)c1ccc(F)cc1 |
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| MolPort-008-512-903 |
0.62 |
CC(C)(C)c1ccc(cc1)C1(CN)CCCC1 |
|
| MolPort-028-673-400 |
0.62 |
O[C@@H](C1CCCCC1)c1ccccc1 |
|
| MolPort-003-991-312 |
0.62 |
COC(CN)Cc1ccccc1 |
|
| MolPort-008-545-971 |
0.62 |
OC(C1CCCC1)c1ccccc1 |
|
| MolPort-004-398-411 |
0.62 |
CCC(N)c1cc(C)ccc1C |
|
| MolPort-005-237-131 |
0.62 |
CC(C)c1ccc(cc1)C1(CN)CCCC1 |
|
| MolPort-008-546-082 |
0.62 |
CCCC(O)c1cc(C)ccc1C |
|
| MolPort-008-546-320 |
0.62 |
CC(C)C(O)c1ccc(Cl)cc1 |
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| MolPort-004-318-149 |
0.62 |
CC(N)Cc1ccc(cc1)C(F)(F)F |
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| MolPort-003-910-769 |
0.62 |
CCC(O)c1ccc(F)cc1 |
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| MolPort-004-302-348 |
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CC(C)Cc1ccc(cc1)C1CO1 |
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| MolPort-028-647-557 |
0.62 |
Cl.Cc1ccc(cc1)[C@@H](N)CCO |
|
| MolPort-008-645-381 |
0.62 |
CCCC(O)c1cccc(C)c1C |
|
| MolPort-008-604-585 |
0.62 |
CCCC(O)c1ccc(C)cc1C |
|
| MolPort-016-583-328 |
0.62 |
Cl.CCC(N)c1ccc(C)c(C)c1 |
|
| MolPort-008-604-695 |
0.62 |
CC(C)Cc1ccc(cc1)C1(C)CO1 |
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| MolPort-042-664-675 |
0.62 |
CC(O)(c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-020-007-547 |
0.62 |
CC[C@H](O)c1cccc(O)c1 |
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| MolPort-038-947-958 |
0.62 |
Cl.NC(CC#C)Cc1ccccc1 |
|
| MolPort-022-367-856 |
0.62 |
CCC(O)c1cccc(O)c1 |
|
| MolPort-025-494-869 |
0.62 |
CCCC(C)(O)c1ccc(C)cc1C |
|
| MolPort-046-655-529 |
0.62 |
C[C@@H](CN)c1c(C)cc(C)cc1C |
|
| MolPort-030-004-888 |
0.62 |
CC(C)(O)c1ccc(CO)cc1 |
|
| MolPort-035-777-737 |
0.62 |
Cl.N[C@@H](C(c1ccccc1)c1ccccc1)C(O)=O |
|
| MolPort-039-241-865 |
0.62 |
CCC(O)(CC(N)=O)c1ccccc1 |
|
| MolPort-046-203-658 |
0.62 |
Cl.CC(C)(O)C(N)Cc1ccc(F)cc1 |
|
| MolPort-030-009-080 |
0.62 |
CC(Cc1ccc(C)cc1)N(C)CCC(C)(C)O |
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| MolPort-026-521-408 |
0.62 |
NC1CCC(O)(CC1)c1ccccc1 |
|
| MolPort-044-203-104 |
0.62 |
Cl.CC(N)(CO)Cc1ccccc1F |
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| MolPort-045-999-389 |
0.62 |
Cl.NCC(CC(O)=O)c1ccc(cc1)C1CC1 |
|
| MolPort-035-765-504 |
0.62 |
Cl.Cl.NCC(CN)c1ccccc1 |
|
| MolPort-022-913-077 |
0.62 |
Cc1cccc(c1)C(CN)CO |
|
| MolPort-028-673-400 |
0.62 |
O[C@@H](C1CCCCC1)c1ccccc1 |
|
| MolPort-022-367-856 |
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CCC(O)c1cccc(O)c1 |
|
| MolPort-023-313-632 |
0.62 |
Cl.CC(N)C(O)Cc1ccccc1 |
|
| MolPort-020-007-547 |
0.62 |
CC[C@H](O)c1cccc(O)c1 |
|
| MolPort-038-947-958 |
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Cl.NC(CC#C)Cc1ccccc1 |
|
| MolPort-022-913-786 |
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NCC(O)CCCc1ccccc1 |
|
| MolPort-028-647-557 |
0.62 |
Cl.Cc1ccc(cc1)[C@@H](N)CCO |
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| MolPort-046-682-656 |
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Cc1ccc(C[C@@H](N)CC(O)=O)cc1 |
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| MolPort-028-766-781 |
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Cl.CN(C)CCc1ccccc1CO |
|
| MolPort-025-494-886 |
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CCCC(C)(O)c1cccc(C)c1C |
|
| MolPort-046-664-204 |
0.62 |
CC(C)C([C@@H](C)CO)c1ccccc1 |
|
| MolPort-046-651-044 |
0.62 |
CCC([C@H](C)CO)c1ccccc1 |
|
| MolPort-038-948-010 |
0.62 |
OCCCc1cccc(CCCO)c1 |
|
| MolPort-035-779-693 |
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CC(C)(O)Cc1ccc2ccccc2c1 |
|
| MolPort-020-073-059 |
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Cl.CC(C)(CN)Cc1ccccc1 |
|
| MolPort-046-652-268 |
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C[C@@H](CN)c1c(C)cccc1C |
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| MolPort-046-659-523 |
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CC(C)C([C@H](C)CO)c1ccccc1 |
|
| MolPort-028-599-994 |
0.62 |
Cl.CC(=O)c1ccc(C[C@H](N)C(O)=O)cc1 |
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| MolPort-046-668-067 |
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C[C@H](CN)Cc1ccc2ccccc2c1 |
|
| MolPort-046-655-805 |
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C[C@H](CN)c1c(C)cccc1C |
|
| MolPort-046-668-058 |
0.62 |
C[C@H](CN)Cc1cccc2ccccc12 |
|
| MolPort-046-664-205 |
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CCC([C@@H](C)CO)c1ccccc1 |
|
| MolPort-046-671-898 |
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C[C@@H](CN)Cc1ccc2ccccc2c1 |
|
| MolPort-028-770-423 |
0.62 |
CC(O)C(C)N1CCN(CC(O)c2ccccc2)CC1 |
|
| MolPort-046-656-515 |
0.62 |
CC(C)C(C(C)CO)c1ccccc1 |
|
| MolPort-026-685-968 |
0.62 |
CC(C)(O)Cc1cccc2ccccc12 |
|
| MolPort-046-655-952 |
0.62 |
C[C@@H](CN)Cc1cccc2ccccc12 |
|
| MolPort-027-143-079 |
0.62 |
CCCC(O)c1ccc(COC)cc1 |
|
| MolPort-042-682-882 |
0.62 |
COc1ccc(C[C@H](N)CO)cc1 |
|
| MolPort-046-793-193 |
0.62 |
Cl.C[C@@H](N)Cc1cccc(c1)C(F)(F)F |
|
| MolPort-042-664-675 |
0.62 |
CC(O)(c1ccccc1)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-035-782-907 |
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Cl.Cc1ccc(CC(C)(C)CN)cc1 |
|
| MolPort-035-782-917 |
0.62 |
Cl.CC(C)(N)Cc1cccc(c1)C(F)(F)F |
|
| MolPort-035-789-446 |
0.62 |
Cl.NC[C@H](O)c1cccc(c1)C#N |
|
| MolPort-023-334-317 |
0.62 |
Cl.NC1CCc2ccccc2C1O |
|
| MolPort-027-025-902 |
0.62 |
CCc1ccc(cc1)C(O)CN(C)CCc1ccccc1 |
|
| MolPort-027-025-884 |
0.62 |
CN(CCc1ccccc1)CC(O)c1ccc(C)cc1 |
|
| MolPort-020-103-943 |
0.62 |
Cl.OC(CNC1CC1)c1ccccc1 |
|
| MCULE-3906381675 |
0.62 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O |
|
| MolPort-046-148-606 |
0.62 |
Cl.NC[C@@H](O)c1cccc(F)c1 |
|
| MCULE-8848992989 |
0.62 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(O)=O)=O |
|
| MolPort-042-622-517 |
0.62 |
Cl.NCC(O)c1cccc(c1)C#N |
|
| MCULE-9287060270 |
0.62 |
C1C(OC)=C2C(C[C@H](C3=CC=CC=C3)OC2=C2C=CC(C)(C)OC2=1)=O |
|
| MolPort-042-620-542 |
0.62 |
CO[C@@H]1[C@H](N)Cc2ccccc12 |
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| MCULE-9275834213 |
0.62 |
C1(C)(C(O)=O)CC(=O)C2C(=CC=CC=2)O1 |
|
| MolPort-044-652-172 |
0.62 |
NCC1(CCCO1)c1ccccc1 |
|
| MCULE-7295377199 |
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C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC)=O |
|
| MolPort-046-666-715 |
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C[C@H](CN)c1c(C)cc(C)cc1C |
|
| MCULE-3283255181 |
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C12OC(C)(C)CCC=1C(=C1CCC(C)(C)OC1=C2OC)C(OC)=O |
|
| MolPort-020-039-612 |
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CC(C)C(O)(CN1CCC(O)CC1)c1ccccc1 |
|
| MCULE-5841905312 |
0.62 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC(C)C)=O |
|
| MolPort-020-015-948 |
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CNC[C@H](O)c1ccc(O)cc1 |
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| MCULE-9244253505 |
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C1(CCC)C(O)=C(C=CC=1OCC1C=CC=CC=1)C(=O)C |
|
| MolPort-035-789-752 |
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Cl.NC[C@H](CC(O)=O)c1ccccc1 |
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| MCULE-5544531525 |
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C1(O)C(C(CC2C(OC)=C(C)C(O)=CC=2OC(C2C=CC=CC=2)=O)C2=C3O[C@H](C4C=CC=CC=4)CCC3=C(OC)C=C2O)=C2O[C@H](C3C=CC=CC=3)CCC2=C(OC)C=1 |
|
| MolPort-020-098-458 |
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Cl.NCC(O)c1c(Cl)cccc1Cl |
|
| MCULE-5471184122 |
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C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC=CC=6)CCC5=C(OC)C=4)[C@H](C3O)C2=C(OC)C=1C)C1C=CC=CC=1 |
|
| MolPort-046-654-846 |
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CCC([C@@H](C)CO)c1ccc(C)cc1 |
|
| MCULE-7192747858 |
0.62 |
C12C(=O)CC(C3C=CC=CC=3)OC1=C1C=CC(C)(C)OC1=CC=2OC |
|
| MolPort-046-655-969 |
0.62 |
CCC([C@H](C)CO)c1ccc(C)cc1 |
|
| MCULE-7443154930 |
0.62 |
C12C=C3C(OCCC3=O)=CC=1OCCC2=O |
|
| MolPort-046-550-224 |
0.62 |
NC[C@H](O)c1cccc(c1)-c1ccc2CCCc2c1 |
|
| MCULE-6489590055 |
0.62 |
C1(O)C=C2OC[C@@]3(O)C4C=CC(OC)=C(C[C@H](O)C(O)(C)C)C=4O[C@@]3([H])C2=CC=1 |
|
| MolPort-046-702-846 |
0.62 |
Cl.C[C@H](N)Cc1cccc(c1)C(F)(F)F |
|
| MCULE-4926347738 |
0.62 |
O1C2=CC=CC=C2C(CC1C(O)=O)=O |
|
| MolPort-046-481-536 |
0.62 |
C[C@H](O)CNCC(O)c1cccc2ccccc12 |
|
| MCULE-4757777373 |
0.62 |
C1C(O)=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(C)=C)OC=12 |
|
| MolPort-046-653-295 |
0.62 |
CCC(C(C)CO)c1ccc(C)cc1 |
|
| MCULE-9196167573 |
0.62 |
C12C(CCC(C)(C)O1)=CC(C=O)=C(OC)C=2 |
|
| MolPort-028-286-804 |
0.62 |
CCC(Cc1ccccc1)N(C)CC#N |
|
| MCULE-1679439172 |
0.62 |
C1C(O)=C2C(C[C@H](C3=CC=CC=C3)OC2=C2C=CC(C)(C)OC2=1)=O |
|
| MolPort-001-793-889 |
0.62 |
CC(O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-046-419-721 |
0.62 |
Cl.COC(=O)c1ccc(cc1)C1(CN)CC1 |
|
| MCULE-5234886160 |
0.62 |
C12C=C(CC)C(=CC=1OCC(C1=CC=CC3OCCOC1=3)C2=O)OC(C)C |
|
| MolPort-002-029-162 |
0.62 |
COC(=O)[C@@H](N)Cc1ccccc1 |
|
| MolPort-020-002-729 |
0.62 |
CNC[C@@H](O)c1ccc(O)cc1 |
|
| MCULE-9959174498 |
0.62 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C2=C(OCCO2)C=1)=O |
|
| MolPort-014-879-130 |
0.62 |
CCc1ccc(cc1)C(C)(C)O |
|
| MolPort-028-751-591 |
0.62 |
Cl.NC[C@@H](CC(O)=O)c1ccccc1 |
|
| MCULE-9463670847 |
0.62 |
C12(C3C=CC=CC=3)C(=O)C3C=CC(=CC=3OC1(O2)C)OC |
|
| MolPort-001-793-696 |
0.62 |
CCc1ccc(CO)cc1 |
|
| MCULE-7371994432 |
0.62 |
C12=CC(Cl)=C(C=C1OC(C(Br)C2=O)C1C=CC=CC=1)C |
|
| MolPort-001-766-696 |
0.62 |
CC(C)c1ccc(CO)cc1 |
|
| MCULE-2067187231 |
0.62 |
C(CC)(C1C(OC)=C(C)C(OCC2C=CC=CC=2)=CC=1)=O |
|
| MolPort-004-399-124 |
0.62 |
CC(C)c1ccc(cc1)C(C)O |
|
| MCULE-3808236318 |
0.62 |
C([C@H](O)C(=O)O)C1=C(OCC2C=CC=CC=2)C=CC=C1 |
|
| MolPort-006-848-350 |
0.62 |
Cl.NCCc1cccc2ccccc12 |
|
| MCULE-2099491698 |
0.62 |
[Cl-].O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C+]1CC2C(=CC(=CC=2OC1C1C=C(O)C(O)=CC=1)O)O |
|
| MolPort-026-521-408 |
0.62 |
NC1CCC(O)(CC1)c1ccccc1 |
|
| MCULE-1588072136 |
0.62 |
C12C(CCOC=1C=C(OC)C=C2OC)=O |
|
| MolPort-005-980-779 |
0.62 |
CC(C)c1ccc(cc1)C(C)(C)O |
|
| MCULE-6768586449 |
0.62 |
C12(CCCCC1C1(C3=CC=C(OC)C=C3O2)CCCCC1)C1=CC=C(C=C1OC(C)C(O)=O)OC |
|
| MolPort-002-133-559 |
0.62 |
Cl.CN(C)CCC(O)(c1ccccc1)c1ccccc1 |
|
| MCULE-7535201943 |
0.62 |
C1(O)C(C)=C2O[C@@H](C3C=CC(O)=CC=3)CCC2=CC=1C(CCC1C(OC)=CC(O)=CC=1)C1C=CC(O)=CC=1 |
|
| MolPort-046-682-656 |
0.62 |
Cc1ccc(C[C@@H](N)CC(O)=O)cc1 |
|
| MCULE-6525563133 |
0.62 |
C1(C(=O)C2C=C(F)C=CC=2OCC2C=CC=CC=2)C(O1)C1=CC=C2C(OCCCO2)=C1 |
|
| MolPort-039-241-865 |
0.62 |
CCC(O)(CC(N)=O)c1ccccc1 |
|
| MCULE-1785374409 |
0.62 |
C12OC(C)(C)C=CC=1C=C1C(=O)C[C@@H](C3C=CC(O)=CC=3)OC1=C2 |
|
| MolPort-008-465-909 |
0.62 |
COc1ccc(CC(N)CO)cc1 |
|
| MCULE-3964122627 |
0.62 |
CC1(C(OC)OC)OC2C(=CC=CC=2)C(=O)C1 |
|
| MolPort-002-902-684 |
0.62 |
OC(CN1CCCC1)c1ccccc1 |
|
| MCULE-5186995240 |
0.62 |
C1OC2=C(C=C(C(OC)=O)C=C2)C(=O)C1 |
|
| MolPort-005-313-519 |
0.62 |
CC(C)c1ccc(cc1)[C@H](C)O |
|
| MCULE-5596378261 |
0.62 |
C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(OC)=O |
|
| MolPort-042-682-882 |
0.62 |
COc1ccc(C[C@H](N)CO)cc1 |
|
| MCULE-7359426276 |
0.62 |
CC1(OC2=C(C=CC=C2)C(=O)C1)C |
|
| MolPort-010-991-904 |
0.62 |
COCC(C)NCC(O)c1ccccc1 |
|
| MCULE-8744659707 |
0.62 |
C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(O)=C(O)C=1 |
|
| MolPort-016-633-588 |
0.62 |
Cl.NC(Cc1ccccc1)C(O)C(F)(F)F |
|
| MCULE-1272584864 |
0.62 |
C1C=C2C(=O)C3(O)C4C=C(OC)C(O)=CC=4OCC3OC2=C2CC(C(CO)=C)OC=12 |
|
| MolPort-002-017-659 |
0.62 |
CN(C)c1ccc(CC(N)CO)cc1 |
|
| MCULE-9997080281 |
0.62 |
COC1=CC2=C(OC(CC2=O)(C)C)C=C1 |
|
| MolPort-001-791-392 |
0.62 |
COC(=O)C(N)Cc1ccccc1 |
|
| MCULE-8293297438 |
0.62 |
C12C=CC(=CC=1OCCC2=O)OC |
|
| MolPort-044-203-104 |
0.62 |
Cl.CC(N)(CO)Cc1ccccc1F |
|
| MCULE-9025356367 |
0.62 |
COC1=C(OC)C(OC)=CC(C(OC2=C3C(C(CC3=O)C)=C(C)C=C2)=O)=C1 |
|
| MolPort-030-004-888 |
0.62 |
CC(C)(O)c1ccc(CO)cc1 |
|
| MCULE-1408558625 |
0.62 |
N(=O)(=O)C1C=CC2=C(C(=O)CC(C3C=CC4=C(OCCCO4)C=3)O2)C=1 |
|
| MolPort-004-399-123 |
0.62 |
CCc1ccc(cc1)C(C)O |
|
| MCULE-5863118612 |
0.62 |
C12=CC(OC)=CC=C1C(CC1(CCCCC1)O2)=O |
|
| MolPort-011-893-318 |
0.62 |
Cc1cccc(c1)C(C)(C)O |
|
| MCULE-9027148478 |
0.62 |
O(C1C(O)C(O)C(CO)OC1C1C(O)=C2C(=O)CC(C3C=CC(O)=CC=3)OC2=CC=1O)C1C(O)C(C(CO1)O)O |
|
| MolPort-003-801-436 |
0.62 |
CC(C)(C)c1ccc(cc1)C(C)(C)O |
|
| MolPort-005-313-421 |
0.62 |
C[C@@H](O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-008-643-849 |
0.62 |
CC(O)c1cc(C)cc(C)c1 |
|
| MolPort-005-313-420 |
0.62 |
C[C@H](O)c1ccc(cc1)C(C)(C)C |
|
| MolPort-011-138-774 |
0.62 |
C[C@@H](O)c1ccc(C)cc1 |
|
| MolPort-012-202-303 |
0.62 |
C[C@H](O)c1ccc(C)cc1 |
|
| MolPort-002-501-662 |
0.62 |
CC(C)(O)c1ccc(cc1)C(C)(C)O |
|
| MolPort-004-793-311 |
0.62 |
CC(C)c1ccc(cc1)[C@@H](C)O |
|
| MolPort-001-837-392 |
0.62 |
Cc1ccc(cc1)C(C)(C)O |
|
| MolPort-035-765-504 |
0.62 |
Cl.Cl.NCC(CN)c1ccccc1 |
|
| MolPort-003-938-521 |
0.62 |
Cl.NCCc1ccc2ccccc2c1 |
|
| MolPort-002-132-334 |
0.62 |
CC(O)c1ccc(cc1)C(C)O |
|
| MolPort-011-138-806 |
0.62 |
C[C@@H](O)c1cccc(C)c1 |
|
| MolPort-001-781-666 |
0.62 |
CC(O)c1cccc(C)c1 |
|
| MolPort-001-789-215 |
0.62 |
CC(O)c1ccc(C)cc1 |
|
| MolPort-012-202-302 |
0.62 |
C[C@H](O)c1cccc(C)c1 |
|
| MolPort-005-980-652 |
0.62 |
Cc1cc(C)cc(c1)C(C)(C)O |
|
| MolPort-005-313-465 |
0.62 |
CCc1ccc(cc1)[C@@H](C)O |
|
| MolPort-001-767-929 |
0.62 |
CC(C)(C)c1ccc(CO)cc1 |
|
| MolPort-045-999-389 |
0.62 |
Cl.NCC(CC(O)=O)c1ccc(cc1)C1CC1 |
|
| MolPort-046-203-658 |
0.62 |
Cl.CC(C)(O)C(N)Cc1ccc(F)cc1 |
|
| MolPort-001-794-155 |
0.62 |
COC(=O)[C@H](N)Cc1ccccc1 |
|
| MolPort-030-009-080 |
0.62 |
CC(Cc1ccc(C)cc1)N(C)CCC(C)(C)O |
|
| MolPort-009-174-540 |
0.62 |
Br.NC(Cc1ccccc1)(Cc1ccccc1)C(O)=O |
|
| MolPort-008-440-384 |
0.62 |
Cl.CC(CCN)c1ccccc1 |
|
| MolPort-008-324-022 |
0.62 |
CC(CN)Cc1cccc2ccccc12 |
|
| MolPort-000-889-179 |
0.62 |
CCC(N)c1ccccc1 |
|
| MolPort-001-787-166 |
0.62 |
OCC(O)c1ccccc1 |
|
| MolPort-046-664-205 |
0.62 |
CCC([C@@H](C)CO)c1ccccc1 |
|
| MolPort-046-668-067 |
0.62 |
C[C@H](CN)Cc1ccc2ccccc2c1 |
|
| MolPort-004-326-498 |
0.62 |
CC(C)(C)C(N)c1ccccc1 |
|
| MolPort-013-889-058 |
0.62 |
CC(O)Cc1cccc2ccccc12 |
|
| MolPort-046-655-952 |
0.62 |
C[C@@H](CN)Cc1cccc2ccccc12 |
|
| MolPort-046-655-805 |
0.62 |
C[C@H](CN)c1c(C)cccc1C |
|
| MolPort-046-671-898 |
0.62 |
C[C@@H](CN)Cc1ccc2ccccc2c1 |
|
| MolPort-046-659-523 |
0.62 |
CC(C)C([C@H](C)CO)c1ccccc1 |
|
| MolPort-003-911-661 |
0.62 |
CCC(C)(N)c1ccccc1 |
|
| MolPort-046-652-268 |
0.62 |
C[C@@H](CN)c1c(C)cccc1C |
|
| MolPort-046-656-515 |
0.62 |
CC(C)C(C(C)CO)c1ccccc1 |
|
| MolPort-046-668-058 |
0.62 |
C[C@H](CN)Cc1cccc2ccccc12 |
|
| MolPort-046-651-044 |
0.62 |
CCC([C@H](C)CO)c1ccccc1 |
|
| MolPort-046-664-204 |
0.62 |
CC(C)C([C@@H](C)CO)c1ccccc1 |
|
| MolPort-003-935-390 |
0.62 |
CC[C@@H](N)c1ccccc1 |
|
| MolPort-003-981-893 |
0.62 |
CC(C)[C@H](N)c1ccccc1 |
|
| MolPort-003-981-892 |
0.62 |
CC(C)[C@@H](N)c1ccccc1 |
|
| MolPort-028-770-423 |
0.62 |
CC(O)C(C)N1CCN(CC(O)c2ccccc2)CC1 |
|
| MolPort-006-756-371 |
0.62 |
Cc1cccc(C)c1CCN |
|
| MolPort-001-794-052 |
0.62 |
CC[C@H](N)c1ccccc1 |
|
| MolPort-014-937-793 |
0.62 |
CC(O)Cc1ccc2ccccc2c1 |
|
| MolPort-003-930-026 |
0.62 |
O[C@H]1CCc2ccccc12 |
|
| MolPort-002-017-704 |
0.62 |
Cc1ccc(cc1)C1(CN)CCOCC1 |
|
| MolPort-035-777-737 |
0.62 |
Cl.N[C@@H](C(c1ccccc1)c1ccccc1)C(O)=O |
|
| MolPort-011-119-271 |
0.62 |
COc1ccc(CC(C)(N)CO)cc1 |
|
| MolPort-029-418-255 |
0.61 |
Cl.NCCCc1cccc(c1)C(O)=O |
|
| MolPort-008-646-219 |
0.61 |
NCCC(O)c1cccc(Cl)c1 |
|
| MolPort-001-758-741 |
0.61 |
Cc1ccccc1C[C@@H](N)C(O)=O |
|
| MolPort-001-741-612 |
0.61 |
C[N+](C)(C)C(Cc1ccccc1)C([O-])=O |
|
| MolPort-000-861-464 |
0.61 |
CN[C@@H](Cc1ccccc1)C(O)=O |
|
| MolPort-000-818-915 |
0.61 |
[Cl-].COC(=O)C([NH3+])Cc1ccccc1 |
|
| MolPort-035-705-666 |
0.61 |
C[N+](C)(C)[C@@H](Cc1ccccc1)C([O-])=O |
|
| MolPort-001-758-742 |
0.61 |
Cc1ccccc1C[C@H](N)C(O)=O |
|
| MolPort-008-647-668 |
0.61 |
CN(C)C(Cc1ccccc1)C(O)=O |
|
| MolPort-004-803-647 |
0.61 |
CCCC(O)c1ccccc1CC |
|
| MolPort-006-237-680 |
0.61 |
CC(C)(C)c1ccc(cc1)C1(CC1)C(N)=O |
|
| MolPort-008-423-240 |
0.61 |
Cc1ccc(cc1)C1(CN)CCCCC1 |
|
| MolPort-004-754-982 |
0.61 |
N[C@@H]1C[C@H]1c1ccc(O)cc1 |
|
| MolPort-000-004-114 |
0.61 |
OC(CC(O)=O)c1ccccc1 |
|
| MolPort-003-891-701 |
0.61 |
CC(=O)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-001-838-129 |
0.61 |
Cc1ccccc1CC(N)C(O)=O |
|
| MolPort-039-239-974 |
0.61 |
CN(C)[C@H](Cc1ccccc1)C(O)=O |
|
| MolPort-020-112-240 |
0.61 |
Cl.Cc1ccc(cc1)C1(CN)CCOCC1 |
|
| MolPort-005-313-466 |
0.61 |
C[C@H](O)c1ccccc1C |
|
| MolPort-027-632-137 |
0.61 |
CCc1cccc(CO)c1 |
|
| MolPort-011-893-287 |
0.61 |
Cc1ccccc1C(C)(C)O |
|
| MolPort-004-792-391 |
0.61 |
CC(C)c1cccc(CO)c1 |
|
| MolPort-001-794-005 |
0.61 |
CC(O)c1ccccc1C |
|
| MolPort-000-157-391 |
0.61 |
Cc1ccccc1CCN |
|
| MolPort-030-086-209 |
0.61 |
CC(C)(C)c1cccc(CO)c1 |
|
| MolPort-005-313-467 |
0.61 |
C[C@@H](O)c1ccccc1C |
|
| MolPort-008-512-866 |
0.61 |
Cc1ccccc1C(C)(C)CN |
|
| MolPort-046-661-277 |
0.61 |
C[C@@H](CN)c1ccccc1C |
|
| MolPort-046-654-817 |
0.61 |
C[C@H](CN)c1ccccc1C |
|
| MolPort-003-983-619 |
0.61 |
OC(C1CCN(CCc2ccccc2)CC1)c1ccccc1 |
|
| MolPort-046-728-000 |
0.61 |
Cl.OC[C@@H]1NC[C@H]1c1ccccc1 |
|
| MolPort-004-033-984 |
0.61 |
OC(CN1CCC(Cc2ccccc2)CC1)c1ccccc1 |
|
| MolPort-003-935-851 |
0.61 |
Cl.COC(=O)[C@H](N)Cc1ccccc1 |
|
| MolPort-044-898-578 |
0.61 |
Cl.COC(=O)C(N)C(C)c1ccccc1 |
|
| MolPort-046-690-789 |
0.61 |
Cl.[2H]c1c([2H])c([2H])c(C[C@H](N)C(=O)OC)c([2H])c1[2H] |
|
| MolPort-020-369-153 |
0.61 |
CNC(Cc1ccccc1)C(O)=O |
|
| MolPort-003-938-594 |
0.61 |
Cl.COC(=O)C(C)(N)Cc1ccccc1 |
|
| MolPort-003-794-232 |
0.61 |
Cl.CC(C)(C)c1ccc(C[C@@H](N)CC(O)=O)cc1 |
|
| MolPort-003-794-080 |
0.61 |
Cl.Cc1ccc(C[C@@H](N)CC(O)=O)cc1 |
|
| MolPort-003-794-079 |
0.61 |
Cl.Cc1ccc(C[C@H](N)CC(O)=O)cc1 |
|
| MolPort-046-589-102 |
0.61 |
NCC(N)(Cc1ccccc1)C(O)=O |
|
| MolPort-035-779-468 |
0.61 |
COc1ccc2cc(ccc2c1)C(C)(O)C(C)C |
|
| MolPort-035-778-636 |
0.61 |
CCCC(O)c1ccccc1C(C)C |
|
| MolPort-035-778-383 |
0.61 |
CCC(C)(O)c1ccc2cc(OC)ccc2c1 |
|
| MolPort-027-845-057 |
0.61 |
Cl.CC1(N)Cc2ccccc2C1 |
|
| MolPort-046-595-011 |
0.61 |
OC(CC#C)(c1ccccc1)c1ccccc1 |
|
| MolPort-046-203-120 |
0.61 |
Cl.C[C@H](N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-044-550-857 |
0.61 |
Br.CC(N)Cc1cccc(O)c1 |
|
| MolPort-042-664-678 |
0.61 |
CC(=N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-039-240-847 |
0.61 |
Cl.CC(N)Cc1cccc(O)c1 |
|
| MolPort-038-077-260 |
0.61 |
N[C@H]1C[C@@H]1c1ccc(O)cc1 |
|
| MolPort-046-678-218 |
0.61 |
Cc1ccc(C)c(c1)C12CC(CN)(C1)C2 |
|
| MolPort-008-546-156 |
0.61 |
CC(O)(CC(O)=O)c1ccccc1 |
|
| MolPort-019-776-324 |
0.61 |
OC1(CCC2CC1CCC2(O)c1ccccc1)c1ccccc1 |
|
| MolPort-012-949-460 |
0.61 |
Cc1cccc(c1C)C(C)(O)C1CC1 |
|
| MolPort-013-285-658 |
0.61 |
CC(C)C(O)C(N)c1ccccc1 |
|
| MolPort-000-003-999 |
0.61 |
OCc1ccc2CCCc2c1 |
|
| MolPort-012-949-060 |
0.61 |
Cc1ccc(C)c(c1)C(C)(O)C1CC1 |
|
| MolPort-011-892-523 |
0.61 |
CC1(O)CCc2ccccc12 |
|
| MolPort-011-186-503 |
0.61 |
CCNC(CC)Cc1ccc(C)cc1 |
|
| MolPort-009-677-274 |
0.61 |
CC[C@H](O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-008-655-618 |
0.61 |
CC(C)C(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-014-793-937 |
0.61 |
Cc1ccc(c(C)c1)C(C)(O)C1CC1 |
|
| MolPort-013-383-015 |
0.61 |
OC1(CC1)c1ccc(Cl)cc1 |
|
| MolPort-008-662-974 |
0.61 |
CC(C)(C)C(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-013-383-021 |
0.61 |
OC1(CC1)c1ccc(F)cc1 |
|
| MolPort-013-382-871 |
0.61 |
OC1(CC1)c1ccc(cc1)C(F)(F)F |
|
| MolPort-046-665-510 |
0.61 |
Cc1ccc(cc1)C1(CO1)C(C)(C)C |
|
| MolPort-035-781-123 |
0.61 |
CCC(C)(O)c1ccc(F)c2ccccc12 |
|
| MolPort-035-777-829 |
0.61 |
CCCC(C)(O)c1ccccc1C(C)C |
|
| MolPort-021-911-612 |
0.61 |
NCC1(CC1)c1ccc(cc1)C(F)(F)F |
|
| MolPort-029-907-563 |
0.61 |
Cl.CC(C)(N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-029-003-694 |
0.61 |
Oc1cccc(c1)C1(O)CC1 |
|
| MolPort-028-949-937 |
0.61 |
Cl.CCC(N)Cc1ccc(O)cc1 |
|
| MolPort-035-779-487 |
0.61 |
CCCC(C)(O)c1ccccc1CC |
|
| MolPort-028-913-237 |
0.61 |
Cc1ccc(CC(C)(C)NC=O)cc1 |
|
| MolPort-026-973-988 |
0.61 |
NC1(Cc2ccc(O)cc2)CC1 |
|
| MolPort-025-503-342 |
0.61 |
OC(CC1CCCCCC1O)c1ccccc1 |
|
| MolPort-025-494-877 |
0.61 |
CCCC(C)(O)c1cc(C)c(C)cc1C |
|
| MolPort-023-334-143 |
0.61 |
CC1(C)OC1c1ccccc1 |
|
| MolPort-023-119-406 |
0.61 |
OCc1ccc(CCC(O)=O)cc1 |
|
| MolPort-020-165-914 |
0.61 |
Cl.CC(N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-001-768-140 |
0.61 |
Cc1ccc(C)c(c1)C(O)C1CC1 |
|
| MolPort-027-845-323 |
0.61 |
O[C@H](CC(O)=O)c1ccccc1 |
|
| MolPort-003-936-835 |
0.61 |
O[C@@H](CC(O)=O)c1ccccc1 |
|
| MolPort-035-780-777 |
0.61 |
Cc1cc(C)c(c(C)c1)C(C)(O)C1CC1 |
|
| MolPort-035-781-755 |
0.61 |
CC(C)C(C)(O)c1ccc(F)c2ccccc12 |
|
| MolPort-002-941-490 |
0.61 |
COC(C(C)c1ccccc1)c1ccccc1 |
|
| MolPort-002-801-371 |
0.61 |
CC(Cc1ccc(O)cc1)N(C)C |
|
| MolPort-002-798-414 |
0.61 |
OC1(CCC(O)(CC1)c1ccccc1)c1ccccc1 |
|
| MolPort-002-500-605 |
0.61 |
CCC(O)c1ccccc1F |
|
| MolPort-001-783-658 |
0.61 |
CCC(C(N)=O)(C(N)=O)c1ccccc1 |
|
| MolPort-001-777-373 |
0.61 |
CCC(O)c1ccc(cc1)C(F)(F)F |
|
| MolPort-009-070-038 |
0.61 |
NCC1Cc2ccccc12 |
|
| MolPort-028-647-043 |
0.61 |
Cl.N[C@@H](CCO)c1cccc2ccccc12 |
|
| MolPort-001-989-938 |
0.61 |
NCC1(CCCC1)c1ccccc1 |
|
| MolPort-020-165-914 |
0.61 |
Cl.CC(N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-028-949-937 |
0.61 |
Cl.CCC(N)Cc1ccc(O)cc1 |
|
| MolPort-046-678-218 |
0.61 |
Cc1ccc(C)c(c1)C12CC(CN)(C1)C2 |
|
| MolPort-044-550-857 |
0.61 |
Br.CC(N)Cc1cccc(O)c1 |
|
| MolPort-029-907-563 |
0.61 |
Cl.CC(C)(N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-021-911-612 |
0.61 |
NCC1(CC1)c1ccc(cc1)C(F)(F)F |
|
| MolPort-027-845-323 |
0.61 |
O[C@H](CC(O)=O)c1ccccc1 |
|
| MolPort-035-780-777 |
0.61 |
Cc1cc(C)c(c(C)c1)C(C)(O)C1CC1 |
|
| MolPort-023-119-406 |
0.61 |
OCc1ccc(CCC(O)=O)cc1 |
|
| MolPort-026-973-988 |
0.61 |
NC1(Cc2ccc(O)cc2)CC1 |
|
| MolPort-039-240-847 |
0.61 |
Cl.CC(N)Cc1cccc(O)c1 |
|
| MolPort-025-494-877 |
0.61 |
CCCC(C)(O)c1cc(C)c(C)cc1C |
|
| MolPort-023-334-143 |
0.61 |
CC1(C)OC1c1ccccc1 |
|
| MolPort-035-781-123 |
0.61 |
CCC(C)(O)c1ccc(F)c2ccccc12 |
|
| MolPort-038-077-260 |
0.61 |
N[C@H]1C[C@@H]1c1ccc(O)cc1 |
|
| MolPort-035-781-755 |
0.61 |
CC(C)C(C)(O)c1ccc(F)c2ccccc12 |
|
| MolPort-046-665-510 |
0.61 |
Cc1ccc(cc1)C1(CO1)C(C)(C)C |
|
| MolPort-046-203-120 |
0.61 |
Cl.C[C@H](N)Cc1ccc(cc1)C(F)(F)F |
|
| MolPort-046-650-702 |
0.61 |
CCC([C@H](C)CN)c1ccc(C)cc1 |
|
| MolPort-046-663-774 |
0.61 |
C[C@@H](CO)CCc1ccc(C)cc1 |
|
| MolPort-046-659-624 |
0.61 |
CCC([C@@H](C)CN)c1ccc(C)cc1 |
|
| MolPort-046-651-028 |
0.61 |
C[C@H](CO)CCc1ccc(C)cc1 |
|
| MolPort-028-979-586 |
0.61 |
CCC(C(C)CN)c1ccc(C)cc1 |
|
| MolPort-028-747-729 |
0.61 |
CCCc1ccc(CCC)cc1 |
|
| MolPort-028-913-237 |
0.61 |
Cc1ccc(CC(C)(C)NC=O)cc1 |
|
| MolPort-035-777-829 |
0.61 |
CCCC(C)(O)c1ccccc1C(C)C |
|
| MolPort-046-691-004 |
0.61 |
Cl.C[15NH][13CH2][13CH](O)c1ccc(O)cc1 |
|
| MolPort-035-778-383 |
0.61 |
CCC(C)(O)c1ccc2cc(OC)ccc2c1 |
|
| MolPort-013-899-571 |
0.61 |
NC1CCCC1c1ccccc1 |
|
| MolPort-046-654-817 |
0.61 |
C[C@H](CN)c1ccccc1C |
|
| MolPort-030-086-209 |
0.61 |
CC(C)(C)c1cccc(CO)c1 |
|
| MolPort-046-661-277 |
0.61 |
C[C@@H](CN)c1ccccc1C |
|
| MolPort-027-632-137 |
0.61 |
CCc1cccc(CO)c1 |
|
| MolPort-029-418-255 |
0.61 |
Cl.NCCCc1cccc(c1)C(O)=O |
|
| MolPort-020-369-153 |
0.61 |
CNC(Cc1ccccc1)C(O)=O |
|
| MolPort-046-690-789 |
0.61 |
Cl.[2H]c1c([2H])c([2H])c(C[C@H](N)C(=O)OC)c([2H])c1[2H] |
|
| MolPort-035-705-666 |
0.61 |
C[N+](C)(C)[C@@H](Cc1ccccc1)C([O-])=O |
|
| MolPort-020-112-240 |
0.61 |
Cl.Cc1ccc(cc1)C1(CN)CCOCC1 |
|
| MolPort-046-589-102 |
0.61 |
NCC(N)(Cc1ccccc1)C(O)=O |
|
| MolPort-046-728-000 |
0.61 |
Cl.OC[C@@H]1NC[C@H]1c1ccccc1 |
|
| MolPort-027-720-052 |
0.61 |
OC(=O)C(O)=O.CN(C)CC[C@@H](O)c1ccccc1 |
|
| MolPort-044-898-578 |
0.61 |
Cl.COC(=O)C(N)C(C)c1ccccc1 |
|
| MolPort-027-853-792 |
0.61 |
OC(=O)C(O)=O.CN(C)CC[C@H](O)c1ccccc1 |
|
| MolPort-039-239-974 |
0.61 |
CN(C)[C@H](Cc1ccccc1)C(O)=O |
|
| MolPort-046-791-015 |
0.61 |
OC(=O)C(O)=O.CN(C)CCC(O)c1ccccc1 |
|
| MolPort-025-503-342 |
0.61 |
OC(CC1CCCCCC1O)c1ccccc1 |
|
| MolPort-035-779-487 |
0.61 |
CCCC(C)(O)c1ccccc1CC |
|
| MolPort-029-003-694 |
0.61 |
Oc1cccc(c1)C1(O)CC1 |
|
| MolPort-035-779-468 |
0.61 |
COc1ccc2cc(ccc2c1)C(C)(O)C(C)C |
|
| MolPort-035-778-636 |
0.61 |
CCCC(O)c1ccccc1C(C)C |
|
| MolPort-046-595-011 |
0.61 |
OC(CC#C)(c1ccccc1)c1ccccc1 |
|
| MolPort-020-096-575 |
0.61 |
Cl.NCC(O)c1c(F)cccc1F |
|
| MolPort-042-664-678 |
0.61 |
CC(=N)C(O)(c1ccccc1)c1ccccc1 |
|
| MolPort-023-040-840 |
0.61 |
CC(C)(C)c1ccc(cc1)C(O)CN=[N+]=[N-] |
|
| MolPort-023-313-536 |
0.61 |
Cl.CC(N)C(OC1CCOCC1)c1ccccc1 |
|
| MolPort-003-846-726 |
0.61 |
[2H]C([2H])([2H])C(N[C@H](C)[C@@H](O)c1cccc(Cl)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H] |
|
| MolPort-046-764-463 |
0.61 |
Cl.[2H]C([2H])([2H])C(N[C@@H](C)[C@H](O)c1cccc(Cl)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H] |
|
| MolPort-046-660-979 |
0.61 |
C[C@H](N)C1OCc2ccccc12 |
|
| MolPort-008-268-140 |
0.61 |
N[C@H](CO)Cc1ccc(OCc2ccccc2)cc1 |
|
| MolPort-002-818-826 |
0.61 |
CCC[C@H](N[C@@H](CCC)[C@H](O)c1ccccc1)[C@H](O)c1ccccc1 |
|
| MolPort-035-801-453 |
0.61 |
CC(N)C(OC(=O)c1ccccc1)c1ccccc1 |
|
| MolPort-046-689-508 |
0.61 |
C[C@H](NC(C)(C)C)[C@H](O)c1cccc(Cl)c1 |
|
| MolPort-046-652-965 |
0.61 |
CC(N)C1OCc2ccccc12 |
|
| MolPort-046-655-521 |
0.61 |
C[C@@H](N)C1OCc2ccccc12 |
|
| MolPort-044-748-593 |
0.61 |
CCNC(=O)NC(C)C(O)c1ccccc1 |
|
| MolPort-023-313-536 |
0.61 |
Cl.CC(N)C(OC1CCOCC1)c1ccccc1 |
|
| MolPort-002-467-264 |
0.61 |
CN(C)C(CN)Cc1ccccc1 |
|
| MolPort-001-791-515 |
0.61 |
OCc1ccccc1CCc1ccccc1 |
|
| MolPort-003-719-456 |
0.61 |
CCCCCC1CCC(CC1)c1ccc(CO)cc1 |
|
| MolPort-001-775-439 |
0.61 |
CC(C)(N)Cc1ccc(F)cc1 |
|
| MolPort-001-772-860 |
0.61 |
NC(Cc1ccccc1)C(F)(F)F |
|
| MolPort-016-583-350 |
0.61 |
Cl.Cc1ccccc1CC1(N)CC1 |
|
| MolPort-014-000-061 |
0.61 |
CCCCc1ccc(cc1)C(O)c1ccccc1 |
|
| MolPort-008-605-012 |
0.61 |
CC(O)c1ccc(cc1)C1CCCCC1 |
|
| MolPort-044-181-423 |
0.61 |
OC(=O)c1ccc2cc(C3CC3)c3ccccc3c2c1 |
|
| MolPort-013-778-056 |
0.61 |
CNC(CN)Cc1ccccc1 |
|
| MolPort-021-369-232 |
0.61 |
CN(C)C(=O)C(O)c1ccccc1 |
|
| MolPort-016-635-858 |
0.61 |
Cl.CC(C)(N)Cc1ccc(Br)cc1 |
|
| MolPort-008-492-714 |
0.61 |
Cc1cccc2c1CCC2(O)CN |
|
| MolPort-003-846-728 |
0.61 |
[2H]C([2H])([2H])C(N[C@@H](C)[C@@H](O)c1cccc(Cl)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H] |
|
| MolPort-046-660-979 |
0.61 |
C[C@H](N)C1OCc2ccccc12 |
|
| MolPort-027-845-057 |
0.61 |
Cl.CC1(N)Cc2ccccc2C1 |
|
| MolPort-028-953-925 |
0.61 |
CC(C)NCC(CCO)c1ccccc1 |
|
| MolPort-028-286-805 |
0.61 |
CCC(Cc1ccccc1)N(C)CCCO |
|
| MolPort-035-881-158 |
0.61 |
CC(=O)OC(CN)c1ccccc1 |
|
| MolPort-026-931-797 |
0.61 |
CC(O)C(C)(CN)Cc1ccccc1 |
|
| MolPort-001-760-221 |
0.61 |
Cl.NCC(O)c1cc(Cl)cc(Cl)c1 |
|
| MolPort-044-853-196 |
0.61 |
CC(N)(Cc1ccccc1)C(F)(F)F |
|
| MolPort-002-469-295 |
0.61 |
CC(C)Cc1ccc(cc1)C(N)C(C)C |
|
| MolPort-038-949-818 |
0.61 |
Cl.CC(C)(N)C(=O)c1ccccc1 |
|
| MolPort-020-096-575 |
0.61 |
Cl.NCC(O)c1c(F)cccc1F |
|
| MolPort-046-678-235 |
0.61 |
CC(C)c1cccc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-003-666-243 |
0.61 |
NC[C@H](O)c1ccc(O)c(O)c1 |
|
| MolPort-046-673-278 |
0.61 |
CC(C)c1cccc(c1)C12CC(N)(C1)C2 |
|
| MolPort-011-284-980 |
0.61 |
NCC(O)c1cc(Cl)cc(Cl)c1 |
|
| MolPort-027-945-983 |
0.61 |
N[C@H](Cc1ccccc1)C(F)(F)F |
|
| MolPort-021-369-232 |
0.61 |
CN(C)C(=O)C(O)c1ccccc1 |
|
| MolPort-046-678-220 |
0.61 |
CCc1cccc(c1)C12CC(CN)(C1)C2 |
|
| MolPort-006-117-022 |
0.61 |
Cl.CNCC(O)c1ccc(O)cc1 |
|
| MolPort-027-945-984 |
0.61 |
N[C@@H](Cc1ccccc1)C(F)(F)F |
|
| MolPort-004-961-141 |
0.61 |
Cc1cccc(CCC#N)c1 |
|
| MolPort-030-537-486 |
0.61 |
Cc1ccc(cc1)[C@H](O)CN=[N+]=[N-] |
|
| MolPort-003-938-517 |
0.61 |
Cl.Cc1cc(C)c(CCN)c(C)c1 |
|
| MolPort-044-181-423 |
0.61 |
OC(=O)c1ccc2cc(C3CC3)c3ccccc3c2c1 |
|
| MolPort-000-164-158 |
0.61 |
CCC(C)c1ccc(cc1)C(N)CC |
|
| MolPort-028-647-043 |
0.61 |
Cl.N[C@@H](CCO)c1cccc2ccccc12 |
|
| MolPort-046-650-702 |
0.61 |
CCC([C@H](C)CN)c1ccc(C)cc1 |
|
| MolPort-046-677-023 |
0.61 |
CCc1cccc(c1)C12CC(N)(C1)C2 |
|
| MolPort-000-164-114 |
0.61 |
CCC(N)c1ccc(cc1)C(C)C |
|
| MolPort-044-748-593 |
0.61 |
CCNC(=O)NC(C)C(O)c1ccccc1 |
|
| MolPort-002-469-510 |
0.61 |
CC(C)C(N)c1ccc(cc1)C(C)(C)C |
|
| MolPort-046-764-463 |
0.61 |
Cl.[2H]C([2H])([2H])C(N[C@@H](C)[C@H](O)c1cccc(Cl)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H] |
|
| MolPort-002-469-374 |
0.61 |
CCCc1ccc(cc1)C(N)C(C)C |
|
| MolPort-046-689-508 |
0.61 |
C[C@H](NC(C)(C)C)[C@H](O)c1cccc(Cl)c1 |
|
| MolPort-028-953-925 |
0.61 |
CC(C)NCC(CCO)c1ccccc1 |
|
| MolPort-046-652-965 |
0.61 |
CC(N)C1OCc2ccccc12 |
|
| MolPort-008-753-513 |
0.61 |
CCc1ccc(CCC(C)(C)O)cc1 |
|
| MolPort-046-655-521 |
0.61 |
C[C@@H](N)C1OCc2ccccc12 |
|
| MolPort-002-859-201 |
0.61 |
Cl.NCC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1 |
|
| MolPort-035-801-453 |
0.61 |
CC(N)C(OC(=O)c1ccccc1)c1ccccc1 |
|
| MolPort-046-663-774 |
0.61 |
C[C@@H](CO)CCc1ccc(C)cc1 |
|
| MolPort-035-765-215 |
0.61 |
Cl.Cc1cccc(c1)[C@H]1C[C@H](N)C1 |
|
| MolPort-028-979-586 |
0.61 |
CCC(C(C)CN)c1ccc(C)cc1 |
|
| MolPort-002-469-294 |
0.61 |
CCC(C)c1ccc(cc1)C(N)C(C)C |
|
| MolPort-000-163-803 |
0.61 |
CCC(N)c1ccc(cc1)C(C)(C)C |
|
| MolPort-002-469-059 |
0.61 |
CC(C)C(N)c1ccc(cc1)C(C)C |
|
| MCULE-9691100622 |
0.61 |
C1C2=C(OC)C=C(C(C(=O)O)=C2OC1C(C)(C)O)CCC1=CC=CC=C1 |
|
| MolPort-002-469-058 |
0.61 |
CCc1ccc(cc1)C(N)C(C)C |
|
| MCULE-6824884051 |
0.61 |
COC1=CC(OCC(C2=CC=CC=C2)=O)=C(C23OC4=CC(OC)=CC=C4C4(CCCCC4)C2CCCC3)C=C1 |
|
| MolPort-002-800-298 |
0.61 |
Cc1cc(CC(C)(C)C)c(C)c(CC(C)(C)C)c1C |
|
| MCULE-2109953476 |
0.61 |
C12C3=CC=CC=C3C=CC=1C(CC(C)(C)O2)=O |
|
| MolPort-008-603-848 |
0.61 |
CNCCc1cccc(C)c1 |
|
| MCULE-1122459209 |
0.61 |
C1(C(CCC)=O)=CC=C(C=C1O)OCC1=CC=CC=C1 |
|
| MolPort-046-651-028 |
0.61 |
C[C@H](CO)CCc1ccc(C)cc1 |
|
| MCULE-8379416608 |
0.61 |
C([C@@H](O)C(=O)OCC)C1=C(OCC2C=CC=CC=2)C=CC=C1 |
|
| MolPort-028-747-729 |
0.61 |
CCCc1ccc(CCC)cc1 |
|
| MCULE-8402032608 |
0.61 |
C12(CCCCC1C1(CCCCC1)C1=C(C=C(C=C1)OC)O2)C1=CC=C(C=C1OCC(O)=O)OC |
|
| MolPort-002-800-302 |
0.61 |
CC(C)(C)Cc1ccc(CC(C)(C)C)cc1 |
|
| MCULE-3163340921 |
0.61 |
C1C=C2C(=O)[C@@]3(O)C4C=C(OC)C(OC)=CC=4OC[C@@]3([H])OC2=C2C[C@H](C(CO)=C)OC=12 |
|
| MolPort-008-268-120 |
0.61 |
N[C@H](CC(O)=O)Cc1ccccc1 |
|
| MCULE-4315177725 |
0.61 |
C1(O)C=C2OC(OC)(C3C=CC(O)=C(O)C=3)C(=O)C2=C(O)C=1 |
|
| MolPort-003-748-959 |
0.61 |
COc1ccc(cc1)C(O)CN |
|
| MCULE-5247936822 |
0.61 |
C12OC(C)(CCC(O)=O)CC(=O)C1=CC=C(OC)C=2OC |
|
| MolPort-003-929-156 |
0.61 |
NC(CC(O)=O)Cc1ccccc1 |
|
| MCULE-4773878278 |
0.61 |
OC1C=CC(=CC=1)C1OC2C(C(=O)C1)=C(C=C(O[C@H]1[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](COC(CC(C)(O)CC(=O)O)=O)O1)C=2)O |
|
| MolPort-038-949-818 |
0.61 |
Cl.CC(C)(N)C(=O)c1ccccc1 |
|
| MCULE-7038902165 |
0.61 |
C1=C2O[C@H](C(=C)C)CC2=C2O[C@@]3([H])COC4C=C(OC)C(OC)=CC=4[C@@]3(O)C(C2=C1)=O |
|
| MolPort-013-891-980 |
0.61 |
COCCCC(N)Cc1ccccc1 |
|
| MCULE-9412247671 |
0.61 |
COC1=C(COC2=C3C(C(CC3=O)C)=C(C)C=C2)C=C(C(C)=O)C=C1 |
|
| MolPort-002-501-569 |
0.61 |
Cc1cccc(c1)[C@H](N)CCO |
|
| MCULE-8390027311 |
0.61 |
C12=CC(=CC=C1OC(CC2=O)(C)C)OCC(OCC)=O |
|
| MolPort-027-945-983 |
0.61 |
N[C@H](Cc1ccccc1)C(F)(F)F |
|
| MCULE-4719487645 |
0.61 |
C12C=C(CC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC |
|
| MolPort-002-499-478 |
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Cc1cccc(c1)[C@@H](N)CCO |
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| MCULE-9948220621 |
0.61 |
C12C=C(CCC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC |
|
| MolPort-026-931-797 |
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CC(O)C(C)(CN)Cc1ccccc1 |
|
| MCULE-8454001547 |
0.61 |
C1=C(CO)C=C2C(C(=O)CC(C3CCC(O3)=O)(O2)C)=C1O |
|
| MolPort-008-646-960 |
0.61 |
OCc1ccc(cc1)C1CCCCC1 |
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| MCULE-5857875122 |
0.61 |
O=C(OC)C1C=CC2C(=O)CCOC=2C=1 |
|
| MolPort-046-677-023 |
0.61 |
CCc1cccc(c1)C12CC(N)(C1)C2 |
|
| MCULE-4339356924 |
0.61 |
C1(O[C@H]2[C@H](O)[C@](CO)(O)CO2)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1 |
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| MolPort-008-550-372 |
0.61 |
CNCC(O)c1ccc(Br)cc1 |
|
| MCULE-2982479295 |
0.61 |
C1(O)C=C2OC[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1 |
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CN(C)c1ccc(cc1)C(O)CN |
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| MCULE-3755625353 |
0.61 |
C12(C(O)=O)CC1C(C1=CC=C(OC)C=C1O2)=O |
|
| MolPort-030-537-486 |
0.61 |
Cc1ccc(cc1)[C@H](O)CN=[N+]=[N-] |
|
| MCULE-2538844083 |
0.61 |
C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(OC)=C(O)C=1 |
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| MolPort-001-611-649 |
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NCC1(CCOCC1)c1ccccc1 |
|
| MCULE-8733210430 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O |
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CCC(Cc1ccccc1)N(C)CCCO |
|
| MCULE-8064214931 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1OC)OC)=O |
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N[C@@H](CC(O)=O)Cc1ccccc1 |
|
| MCULE-5907594280 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OC)=O |
|
| MolPort-035-881-158 |
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CC(=O)OC(CN)c1ccccc1 |
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| MCULE-2305079825 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1)=O |
|
| MolPort-046-678-235 |
0.61 |
CC(C)c1cccc(c1)C12CC(CN)(C1)C2 |
|
| MCULE-5129492374 |
0.61 |
O(C1C(C/C=C(\C)/C)=C2O[C@H](C3=CC(O)=C(O)C(C/C=C(\C)/C)=C3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
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Cl.CC(N)Cc1ccc(Br)cc1 |
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| MCULE-1434608117 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)OC)=O |
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| MolPort-014-433-627 |
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CNCC(O)c1ccc(cc1)C#N |
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| MCULE-7729342140 |
0.61 |
C1C=C(C(=O)C2C3OC(C)(C)CCC=3C(O)=CC=2O)C=CC=1 |
|
| MolPort-046-673-278 |
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CC(C)c1cccc(c1)C12CC(N)(C1)C2 |
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| MCULE-6894860287 |
0.61 |
C(CC)(C1C=CC(OCC2C=CC=CC=2)=C(C)C=1O)=O |
|
| MolPort-002-499-477 |
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Cc1cccc(c1)C(N)CCO |
|
| MCULE-1297466490 |
0.61 |
[C@H]1(OC(=O)C)[C@H](OC2C=CC3C(=O)CC(C4C=CC=CC=4)OC=3C=2)O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C |
|
| MolPort-027-945-984 |
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N[C@@H](Cc1ccccc1)C(F)(F)F |
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| MCULE-8557519104 |
0.61 |
C1(OC(C)=O)[C@H](OC2=CC(O)=C3C(O[C@@H](CC3=O)C3C=CC(=C(OC(C)=O)C=3)OC)=C2)O[C@@H](C(OC(C)=O)[C@@H]1OC(C)=O)CO[C@@H]1OC(C)[C@@H](C(OC(C)=O)C1OC(C)=O)OC(C)=O |
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| MolPort-035-765-215 |
0.61 |
Cl.Cc1cccc(c1)[C@H]1C[C@H](N)C1 |
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| MCULE-9292245335 |
0.61 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC=C(C=C1)OC(C)C)=O |
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| MolPort-001-793-798 |
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CCC(C(N)=O)c1ccccc1 |
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| MCULE-7542758724 |
0.61 |
C(=O)(C1=C(OCC2=CC=C(OC)C=C2)C=CC=C1OCC1CC1)C |
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| MolPort-004-754-847 |
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CC1C(N)Cc2ccccc12 |
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| MCULE-1096692232 |
0.61 |
C12C(CCOC1=C(C=C(C(O)=O)C=2)OC)=O |
|
| MolPort-044-853-196 |
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CC(N)(Cc1ccccc1)C(F)(F)F |
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| MCULE-9221415167 |
0.61 |
C1(C)(C)CC(C2=CC(=C(O)C=C2O1)Cl)=O |
|
| MolPort-046-659-624 |
0.61 |
CCC([C@@H](C)CN)c1ccc(C)cc1 |
|
| MCULE-6744641772 |
0.61 |
C12C=CC(=C(C)C=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC |
|
| MolPort-046-678-220 |
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CCc1cccc(c1)C12CC(CN)(C1)C2 |
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| MCULE-4387068084 |
0.61 |
C(CCC1C(C)=CC(OC)=C(OCC2C=CC=CC=2)C=1)(C1C(O)=CC(OC)=C(OC)C=1)=O |
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| MolPort-046-691-004 |
0.61 |
Cl.C[15NH][13CH2][13CH](O)c1ccc(O)cc1 |
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| MCULE-6625145109 |
0.61 |
C1(C(OCC)=O)OC2=CC(OCC3=CC=CC=C3)=CC=C2CC1 |
|
| MolPort-006-013-353 |
0.61 |
NCC(O)c1cccc(c1)C(F)(F)F |
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| MCULE-8847245497 |
0.61 |
C1C(C(C2C(C3=CC(OC)=CC(OC)=C3)O2)=O)=CC=C(OC)C=1 |
|
| MolPort-016-636-291 |
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Cl.CNCC(O)c1ccc(F)cc1 |
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| MCULE-2003622907 |
0.61 |
OCC1(OC2C(=C(C(=C(C)C=2CC1)OCC1C=CC=CC=1)C)C)C |
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| MolPort-023-040-840 |
0.61 |
CC(C)(C)c1ccc(cc1)C(O)CN=[N+]=[N-] |
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| MCULE-9661043594 |
0.61 |
C1(C(C2C=CC=CC=2)=O)C(O1)C1C=C(C(OC)=C(OC)C=1)OC |
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| MolPort-008-752-211 |
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Cc1ccc(CCC(C)(C)O)cc1 |
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| MCULE-8789119815 |
0.61 |
C1(C(=O)COC)=CC=C(OCC2C=CC=CC=2)C=C1OCC1C=CC=CC=1 |
|
| MolPort-013-023-984 |
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CCC(O)(CC)c1ccc(Cl)cc1 |
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| MolPort-000-889-181 |
0.61 |
CCC(N)c1ccc(C)cc1 |
|
| MolPort-006-129-586 |
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Cc1ccc(CCCCO)cc1 |
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| MolPort-000-150-275 |
0.61 |
Cl.COC(=O)[C@@H](N)Cc1ccccc1 |
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| MolPort-027-720-052 |
0.61 |
OC(=O)C(O)=O.CN(C)CC[C@@H](O)c1ccccc1 |
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| MolPort-027-853-792 |
0.61 |
OC(=O)C(O)=O.CN(C)CC[C@H](O)c1ccccc1 |
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| MolPort-001-792-418 |
0.61 |
CN(C)[C@@H](Cc1ccccc1)C(O)=O |
|
| MolPort-008-267-985 |
0.61 |
CN[C@H](Cc1ccccc1)C(O)=O |
|
| MolPort-008-365-889 |
0.61 |
CC(C)[C@@H](CO)NC(C)C(c1ccccc1)c1ccccc1 |
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| MolPort-002-497-765 |
0.61 |
Cl.COC(=O)C(N)Cc1ccccc1 |
|
| MolPort-046-791-015 |
0.61 |
OC(=O)C(O)=O.CN(C)CCC(O)c1ccccc1 |
|
| MCULE-2575175530 |
0.60 |
C1(O)C=C2OCC(C3C(OC)=CC(OC)=CC=3)C(=O)C2=C(O)C=1 |
|
| MolPort-003-793-999 |
0.60 |
Cl.N[C@H](CC(O)=O)Cc1ccccc1 |
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| MCULE-1427011280 |
0.60 |
C1C=C(C(=O)C2C(O)=C3CCC(C)(C)OC3=CC=2O)C=CC=1 |
|
| MolPort-046-651-657 |
0.60 |
CCC(Cc1ccccc1)[C@H](C)CO |
|
| MCULE-8155191339 |
0.60 |
O1C2=CC=C(C=C2[C@@H]2CCC[C@@H]2[C@@H]1C1=CC=C(C=C1)O)O |
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| MolPort-001-762-123 |
0.60 |
CC(C)Cc1ccccc1 |
|
| MCULE-5171604572 |
0.60 |
C12=CC(=CC=C1OC(CC2=O)C1C=C(OC)C(=C(OC)C=1)OC)NC(CCC)=O |
|
| MolPort-012-215-013 |
0.60 |
CNCC(N)Cc1ccccc1 |
|
| MCULE-3731350946 |
0.60 |
C1(C)(C(OC)=O)OC2=C(C(C)=C(OCC3=CC=CC=C3)C(C)=C2C)CC1 |
|
| MolPort-002-567-464 |
0.60 |
CC(N)C(CC(O)=O)c1ccccc1 |
|
| MCULE-6644566955 |
0.60 |
C1(O)C=C2OC[C@@]3([H])C4C=CC(O)=C(CCC(O)(C)C)C=4O[C@@]3([H])C2=CC=1 |
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| MolPort-002-736-439 |
0.60 |
NCC(C1CCCCC1)c1ccccc1 |
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| MCULE-2731378392 |
0.60 |
O1CCCC(=O)C2=CC=C(O)C(C)=C12 |
|
| MolPort-002-798-574 |
0.60 |
CN(C)CC(O)c1ccccc1I |
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| MCULE-1708111551 |
0.60 |
O1CCCC(=O)C2=CC(C)=C(O)C=C12 |
|
| MolPort-004-300-179 |
0.60 |
Cc1cccc(CC2CNC2)c1 |
|
| MCULE-5855528622 |
0.60 |
C1(O)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1 |
|
| MolPort-003-662-704 |
0.60 |
CCC(C)c1ccc(cc1)C(O)=O |
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| MCULE-2417211351 |
0.60 |
O=C1C2C(=CC=CC=2OCC1)OC |
|
| MolPort-003-735-330 |
0.60 |
NC1(Cc2ccccc2)CCCCC1 |
|
| MCULE-6850678354 |
0.60 |
C1(C(CCCC)=O)C=CC(=CC=1O)OC(=O)C1=CC=C(C=C1)OCCCCCCCC |
|
| MolPort-003-748-981 |
0.60 |
CNCC(O)c1ccc(Cl)cc1 |
|
| MCULE-8334599085 |
0.60 |
C12C(O[C@@H](C3C=CC(O)=CC=3)[C@@H]3[C@H]1CCC3)=CC=C(O)C=2 |
|
| MolPort-002-559-386 |
0.60 |
CN(C)CCCNCC(O)c1ccccc1 |
|
| MCULE-6236774330 |
0.60 |
CCOC1=C(COC2=C3C(C(CC3=O)C)=C(C)C=C2)C=C(C(C)=O)C=C1 |
|
| MolPort-003-801-456 |
0.60 |
CC(C)(C)Cc1ccc(cc1)C(O)=O |
|
| MCULE-8993464455 |
0.60 |
O=C1C2=CC=CC(OCC3=CC=CC=C3)=C2CC1 |
|
| MolPort-046-660-844 |
0.60 |
C[C@H](CO)CC(C)c1ccccc1 |
|
| MCULE-3699837422 |
0.60 |
C12CC(O)C(OC=1C(C(=O)O)=C(CCC1C=CC=CC=1)C=C2OC)(C)CC/C=C(\C)/C |
|
| MolPort-003-801-485 |
0.60 |
CCC(C)(C)c1ccc(cc1)C(O)=O |
|
| MCULE-2105773128 |
0.60 |
C1(OC2=CC(=C3C(=O)CC(C4C(O)=CC=CC=4)OC3=C2)O)OC(C(C(C1O)O)O)C(=O)OC |
|
| MolPort-004-040-725 |
0.60 |
CN(C)CC(C)(C)CNCC(O)c1ccccc1 |
|
| MCULE-3786850617 |
0.60 |
C12C(=O)C3(O)C4C=CC(O)=CC=4OC3(O)C=1C=CC=C2 |
|
| MolPort-003-908-987 |
0.60 |
Cl.CCC(C)(N)c1ccccc1 |
|
| MCULE-3752499681 |
0.60 |
C1(CC(=O)C2C(=CC=C(Cl)C=2)O1)C1=CC=C(C=C1Cl)Cl |
|
| MolPort-003-927-517 |
0.60 |
CCC(C)c1ccccc1 |
|
| MCULE-2022652192 |
0.60 |
C(CCC1C=C(OC)C(OC)=C(OC)C=1)(C1=CC=C(OCC2C=CC=CC=2)C(OC)=C1)=O |
|
| MolPort-003-936-749 |
0.60 |
C[C@H](O)CCc1ccccc1 |
|
| MCULE-6888108556 |
0.60 |
C1(OC2C(O)C(O)C(CO)O2)C=C2OC(C3C=CC(O)=CC=3)C(O)CC2=C(O)C=1 |
|
| MolPort-003-938-844 |
0.60 |
Cl.NCC(O)c1ccc(O)c(O)c1 |
|
| MCULE-6148416904 |
0.60 |
C12=C(Br)C(OCC3=CC=CC=C3)=CC(OCC3C=CC=CC=3)=C1C[C@H](OCC1C=CC=CC=1)[C@@H](C1C=CC(=C(OCC3C=CC=CC=3)C=1)OCC1C=CC=CC=1)O2 |
|
| MolPort-003-794-436 |
0.60 |
Cl.N[C@@H](CC(O)=O)Cc1ccccc1 |
|
| MCULE-2331262877 |
0.60 |
C1(COC2=C(C=CC(OC)=C2)C1=O)C1C(OC)=CC(=C(OC)C=1OC)OC |
|
| MolPort-019-994-598 |
0.60 |
NNC(=O)[C@H](O)c1ccccc1 |
|
| MCULE-2097447105 |
0.60 |
C1(C(O)=CC2=C(CCC(C)(C)O2)C=1OC)C(=O)CC1=CC=C(OC)C=C1 |
|
| MolPort-004-409-231 |
0.60 |
CN(C)CC(N)Cc1ccccc1 |
|
| MCULE-9855406016 |
0.60 |
C1(O[C@@H]2OC(C)[C@@H](C(OC(C)=O)C2OC(C)=O)OC(C)=O)[C@H](OC2=CC(O)=C3C(O[C@@H](CC3=O)C3=CC=C(C=C3)OC(C)=O)=C2)O[C@@H](C(OC(C)=O)[C@@H]1OC(C)=O)COC(C)=O |
|
| MolPort-001-777-346 |
0.60 |
Cl.CC(N)Cc1ccc(F)cc1 |
|
| MCULE-6647372730 |
0.60 |
C(=C(/C)\C)\CC1C(=C2C(OC(C)C(C)C2=O)=C(C(CC(=O)O)CCC)C=1OC)O |
|
| MolPort-046-147-512 |
0.60 |
Cl.COc1ccc(cc1)[C@@H](O)CN |
|
| MCULE-8825842429 |
0.60 |
C12OC(CC(=O)C=1C(C)=CC(OCC1=C(Cl)C=CC=C1F)=C2)(C)C |
|
| MolPort-046-655-161 |
0.60 |
CCC([C@H](C)CN)c1ccccc1 |
|
| MCULE-1723755110 |
0.60 |
C12OC(CC(=O)C1=CC=C(O)C=2CCC)(C)CCC(=O)OC |
|
| MolPort-046-660-830 |
0.60 |
C[C@@H](N)C(c1ccccc1)C(F)(F)F |
|
| MCULE-9337445879 |
0.60 |
C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C2C=CC=CC=12)OC)=O |
|
| MolPort-009-086-374 |
0.60 |
NC(CC1CCCCC1)Cc1ccccc1 |
|
| MCULE-3258174363 |
0.60 |
C1OC2=C(C=C(C(O)=O)C=C2)C(=O)C1 |
|
| MolPort-046-652-631 |
0.60 |
C[C@H](N)C(C(F)F)c1ccccc1 |
|
| MCULE-3564308719 |
0.60 |
CCCCOC1=C(OCC)C=C(C(OC(C(C2=C(OC)C=C(OC)C=C2)=O)C)=O)C=C1 |
|
| MolPort-000-141-920 |
0.60 |
CCCc1ccc(cc1)C(O)=O |
|
| MCULE-5134357150 |
0.60 |
C1(C=C(C=C2COCOC=12)C(O)=O)C1CC(=O)C2=C(C=C(C(C)=C2)C)O1 |
|
| MolPort-000-156-714 |
0.60 |
NNC(=O)C(O)c1ccccc1 |
|
| MCULE-3177740984 |
0.60 |
C1(C(C2=CC=CC=C2O)C2C(=O)C3C=CC(=CC=3OC2=O)O)C(=O)C2C=CC(=CC=2OC1=O)O |
|
| MolPort-000-702-190 |
0.60 |
Cl.NCC1(CCCC1)c1ccccc1 |
|
| MCULE-1528499595 |
0.60 |
C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(O)C=1)OC)=O |
|
| MolPort-000-860-812 |
0.60 |
OC(C[N+]([O-])=O)c1ccccc1 |
|
| MCULE-5633707092 |
0.60 |
C1(C(=O)C=CC2C=CC=CC=2)=CC2CCC(C3C=CC=CC=3)OC=2C=C1O |
|
| MolPort-000-868-859 |
0.60 |
CC(C)(CO)NCCc1ccccc1 |
|
| MCULE-1106597474 |
0.60 |
O1C2C=CC=CC=2C(CC1C1=CC=C(C(COC2C=CC(=CC=2)NC(C)=O)=C1)OC)=O |
|
| MolPort-000-870-361 |
0.60 |
NCC1(CCCCC1)c1ccccc1 |
|
| MCULE-1278873428 |
0.60 |
O1C2C=CC=CC=2C(CC1C1=CC=C(C(CN2CCOCC2)=C1)OC)=O |
|
| MolPort-000-000-926 |
0.60 |
Cl.NCC(O)c1cccc(c1)C(F)(F)F |
|
| MCULE-3778540596 |
0.60 |
C12(C(OC)=O)CC1C(C1=CC=C(OC)C=C1O2)=O |
|
| MolPort-001-011-883 |
0.60 |
N\C(=N/O)C(O)c1ccccc1 |
|
| MCULE-4806891809 |
0.60 |
COC(C1COCC1)COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1 |
|
| MolPort-004-851-544 |
0.60 |
CC(CNC(C)(C)CO)c1ccccc1 |
|
| MCULE-5581625093 |
0.60 |
C1(O)C=C2OC(C3C=C(O)C(O)=CC=3)C(OC3(C4C=C(O)C(O)=CC=4)OC4=CC(O)=CC(O)=C4C(O)C3O)CC2=C(O)C=1 |
|
| MolPort-013-676-681 |
0.60 |
NC(CC=C)Cc1ccccc1 |
|
| MCULE-2827316384 |
0.60 |
C12OC3(CCCCC3)CC(=O)C1=CC=C1OC(=O)CC(CC(C)C)C=21 |
|
| MolPort-046-651-968 |
0.60 |
CCC([C@@H](C)CN)c1ccccc1 |
|
| MolPort-013-944-319 |
0.60 |
CC(O)Cc1cc(C)cc(C)c1 |
|
| MolPort-046-660-522 |
0.60 |
C[C@H](N)C(c1ccccc1)C(F)(F)F |
|
| MolPort-013-944-215 |
0.60 |
Cc1cc(C)cc(CC(C)(C)O)c1 |
|
| MolPort-046-653-280 |
0.60 |
CC(N)C(C(F)F)c1ccccc1 |
|
| MolPort-013-899-606 |
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NC1CCCCCC1c1ccccc1 |
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| MolPort-046-654-247 |
0.60 |
C[C@@H](CO)CC(C)(C)c1ccccc1 |
|
| MolPort-003-940-423 |
0.60 |
CC(C)(O)CCc1ccccc1 |
|
| MolPort-046-654-853 |
0.60 |
CCC(Cc1ccccc1)[C@@H](C)CO |
|
| MolPort-004-768-698 |
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NC(=O)C1(CC1)c1ccccc1 |
|
| MolPort-046-656-109 |
0.60 |
CC(N)C(c1ccccc1)C(F)(F)F |
|
| MolPort-046-656-512 |
0.60 |
CC(CO)CC(C)(C)c1ccccc1 |
|
| MolPort-046-657-471 |
0.60 |
CCC(Cc1ccccc1)C(C)CO |
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| MolPort-046-658-221 |
0.60 |
CC(C)C([C@@H](C)CN)c1ccccc1 |
|
| MolPort-005-237-086 |
0.60 |
NCC1(CCCCCC1)c1ccccc1 |
|
| MolPort-046-668-077 |
0.60 |
CC(C)C([C@H](C)CN)c1ccccc1 |
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| MolPort-019-372-847 |
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CCCc1ccccc1 |
|
| MolPort-039-136-793 |
0.60 |
Cl.CC(C)(C)[C@H](N)c1ccccc1 |
|
| MolPort-046-651-968 |
0.60 |
CCC([C@@H](C)CN)c1ccccc1 |
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| MolPort-044-198-417 |
0.60 |
Cl.N[C@@H]1CCC[C@@H]1c1ccccc1 |
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| MolPort-044-198-237 |
0.60 |
Cl.CC(C)(N)C(C(O)=O)c1ccccc1 |
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| MolPort-044-181-437 |
0.60 |
OS(O)(=O)=O.N[C@@H]1C[C@H]1c1ccccc1.N[C@@H]1C[C@H]1c1ccccc1 |
|
| MolPort-020-014-059 |
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Cl.CC(C)[C@H](N)c1ccccc1 |
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| MolPort-042-604-560 |
0.60 |
Cl.C[C@@H]1[C@H](N)Cc2ccccc12 |
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| MolPort-044-729-580 |
0.60 |
Cl.CC(C)(N)C(F)c1ccccc1 |
|
| MolPort-044-832-121 |
0.60 |
Cl.CC(N)(Cc1ccccc1)C(F)F |
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| MolPort-044-853-195 |
0.60 |
Cl.CC(N)(Cc1ccccc1)C(F)(F)F |
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| MolPort-039-136-794 |
0.60 |
Cl.CC(C)(C)[C@@H](N)c1ccccc1 |
|
| MolPort-020-071-995 |
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Cl.Cc1ccccc1C1(C)CC1N |
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| MolPort-038-948-196 |
0.60 |
Cl.N[C@@H]1CCC[C@H]1c1ccccc1 |
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| MolPort-046-656-109 |
0.60 |
CC(N)C(c1ccccc1)C(F)(F)F |
|
| MolPort-046-147-512 |
0.60 |
Cl.COc1ccc(cc1)[C@@H](O)CN |
|
| MolPort-021-783-756 |
0.60 |
Cl.CC(C)[C@@H](N)c1ccccc1 |
|
| MolPort-019-994-598 |
0.60 |
NNC(=O)[C@H](O)c1ccccc1 |
|
| MolPort-046-651-041 |
0.60 |
C[C@H](CO)CC(C)(C)c1ccccc1 |
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| MolPort-035-769-780 |
0.60 |
Cl.NCC1(CCOCC1)c1ccccc1 |
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| MolPort-035-765-360 |
0.60 |
Cl.Cc1ccccc1[C@@H]1C[C@H]1N |
|
| MolPort-020-168-168 |
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Cl.COC(CN)c1ccc(Cl)cc1 |
|
| MolPort-035-385-948 |
0.60 |
Cl.NC1Cc2ccccc12 |
|
| MolPort-033-355-980 |
0.60 |
Cl.CNC(C)Cc1ccccc1C |
|
| MolPort-020-418-721 |
0.60 |
Cc1ccc(cc1F)C(O)CN |
|
| MolPort-046-651-657 |
0.60 |
CCC(Cc1ccccc1)[C@H](C)CO |
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| MolPort-021-784-829 |
0.60 |
Cl.CC(C)C(N)c1ccccc1 |
|
| MolPort-046-653-280 |
0.60 |
CC(N)C(C(F)F)c1ccccc1 |
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| MolPort-044-853-195 |
0.60 |
Cl.CC(N)(Cc1ccccc1)C(F)(F)F |
|
| MolPort-028-758-282 |
0.60 |
Cl.NC1(Cc2ccccc2)CCCC1 |
|
| MolPort-046-665-074 |
0.60 |
C[C@@H](CO)CC(C)c1ccccc1 |
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| MolPort-027-545-428 |
0.60 |
CC(O)(CCN)Cc1ccccc1 |
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| MolPort-046-672-034 |
0.60 |
C[C@@H](N)C(C(F)F)c1ccccc1 |
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| MolPort-027-807-729 |
0.60 |
N[C@@H]1CCCC[C@H]1c1ccccc1 |
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| MolPort-046-660-844 |
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C[C@H](CO)CC(C)c1ccccc1 |
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| MolPort-046-660-830 |
0.60 |
C[C@@H](N)C(c1ccccc1)C(F)(F)F |
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| MolPort-046-660-522 |
0.60 |
C[C@H](N)C(c1ccccc1)C(F)(F)F |
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| MolPort-028-606-870 |
0.60 |
C[N+](C)(C)C1CC1c1ccccc1 |
|
| MolPort-046-675-664 |
0.60 |
Cc1cc(C)cc(CC23CC(N)(C2)C3)c1 |
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| MolPort-046-658-221 |
0.60 |
CC(C)C([C@@H](C)CN)c1ccccc1 |
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| MolPort-046-676-101 |
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Cc1cc(C)cc(CC23CC(CN)(C2)C3)c1 |
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| MolPort-046-657-471 |
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CCC(Cc1ccccc1)C(C)CO |
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| MolPort-046-654-247 |
0.60 |
C[C@@H](CO)CC(C)(C)c1ccccc1 |
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| MolPort-046-652-631 |
0.60 |
C[C@H](N)C(C(F)F)c1ccccc1 |
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| MolPort-046-656-512 |
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CC(CO)CC(C)(C)c1ccccc1 |
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| MolPort-046-677-265 |
0.60 |
Cl.N[C@H]1CCC[C@H]1c1ccccc1 |
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| MolPort-044-432-394 |
0.60 |
Cl.OC1(CNC1)c1ccc(F)cc1 |
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| MolPort-028-951-631 |
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Cl.CC(C)C(Cc1ccccc1)NN |
|
| MolPort-046-655-161 |
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CCC([C@H](C)CN)c1ccccc1 |
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| MolPort-046-654-853 |
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CCC(Cc1ccccc1)[C@@H](C)CO |
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| MolPort-046-678-529 |
0.60 |
Cc1cccc(CC23CC(CN)(C2)C3)c1 |
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CCC(C(C)CN)c1ccccc1 |
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| MolPort-021-945-721 |
0.60 |
NCC(O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F |
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| MolPort-029-006-319 |
0.60 |
OCc1ccccc1C1CCC1 |
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| MolPort-046-426-872 |
0.60 |
OS(O)(=O)=O.NC1CC1c1ccccc1.NC1CC1c1ccccc1 |
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| MolPort-046-700-406 |
0.60 |
Cl.NC1(CCCC1)C(O)c1ccc(F)cc1 |
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| MolPort-020-249-453 |
0.60 |
OC(C1CCCN1)c1ccccc1 |
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| MolPort-044-181-437 |
0.60 |
OS(O)(=O)=O.N[C@@H]1C[C@H]1c1ccccc1.N[C@@H]1C[C@H]1c1ccccc1 |
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| MolPort-001-758-822 |
0.60 |
N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |
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| MolPort-029-939-581 |
0.60 |
Cl.NC(Cc1ccc(CC(O)=O)cc1)C(O)=O |
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| MolPort-027-853-488 |
0.60 |
Cc1ccc(cc1)C1C[C@@H](O)[C@@H](O)[C@@H]1N |
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| MolPort-002-500-772 |
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OC1(CCCNC1)c1ccccc1 |
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| MolPort-020-249-453 |
0.60 |
OC(C1CCCN1)c1ccccc1 |
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| MolPort-001-790-855 |
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CC(C)N[C@@H]([C@@H](O)c1ccccc1)c1ccccc1 |
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| MolPort-005-158-802 |
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Cc1cccc(CCN2CCC(O)(C2)c2ccccc2)c1 |
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0.60 |
CC(C)N[C@H]([C@H](O)c1ccccc1)c1ccccc1 |
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| MolPort-046-700-406 |
0.60 |
Cl.NC1(CCCC1)C(O)c1ccc(F)cc1 |
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0.60 |
COc1ccc(cc1)[C@@H](O)[C@@H](N)c1ccccc1 |
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Cl.CC(C)(N)C(C(O)=O)c1ccccc1 |
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CNCC(C)(C)c1ccc(C)cc1 |
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0.60 |
Cl.N[C@@H](Cc1ccc(CC(O)=O)cc1)C(O)=O |
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COC(CN)c1ccc(Cl)cc1 |
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Cl.C[C@@H]1[C@H](N)Cc2ccccc12 |
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0.60 |
C[N+](C)(C)C1CC1c1ccccc1 |
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Cl.NC1(Cc2ccccc2)CCCC1 |
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0.60 |
Cl.N[C@@H]1CCC[C@@H]1c1ccccc1 |
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Cl.CC(C)(N)C(F)c1ccccc1 |
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Cl.OC1(CNC1)c1ccc(F)cc1 |
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NCC1(CC1)c1ccc(Br)cc1 |
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0.60 |
Cl.CC(C)(C)[C@@H](N)c1ccccc1 |
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Cl.Cc1ccccc1C1(C)CC1N |
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| MolPort-044-832-121 |
0.60 |
Cl.CC(N)(Cc1ccccc1)C(F)F |
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0.60 |
CC[C@H](C)[C@@H](CO)NC(C)Cc1ccc(C)cc1 |
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0.60 |
N[C@H](Cc1ccc(cc1)C#N)C(O)=O |
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0.60 |
N[C@@H](Cc1ccc(cc1)-c1ccc(C[C@H](N)C(O)=O)cc1)C(O)=O |
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Cl.N[C@@H](Cc1ccc(CC(O)=O)cc1)C(O)=O |
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| MolPort-027-853-488 |
0.60 |
Cc1ccc(cc1)C1C[C@@H](O)[C@@H](O)[C@@H]1N |
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| MolPort-029-939-581 |
0.60 |
Cl.NC(Cc1ccc(CC(O)=O)cc1)C(O)=O |
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N[C@@H](Cc1ccc(cc1)-c1ccc(C[C@H](N)C(O)=O)cc1)C(O)=O |
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CC(C)[C@@H](CO)NCCc1ccc(C)cc1 |
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NCCc1ccc(O)c(CO)c1 |
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| MolPort-046-677-018 |
0.60 |
Cc1cccc(CC23CC(N)(C2)C3)c1 |
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| MolPort-012-885-761 |
0.60 |
NCc1cccc(c1)C1CC1 |
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| MolPort-013-997-250 |
0.60 |
CC(C)(C)CC(O)c1ccc(Br)cc1 |
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| MolPort-001-815-866 |
0.60 |
CCCC(O)c1ccc(Br)cc1 |
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| MolPort-044-422-822 |
0.60 |
NCCc1ccc(O)c(CO)c1 |
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| MolPort-003-847-513 |
0.60 |
CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1 |
|
| MolPort-006-013-051 |
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NCCc1cccc(c1)C(O)=O |
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| MolPort-030-024-694 |
0.60 |
CC(C)[C@@H](CO)NCCc1ccc(C)cc1 |
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0.60 |
OC(C(=C)C#N)c1ccccc1 |
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0.60 |
Cc1ccc(CC(O)CN)c(C)c1 |
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| MolPort-016-635-860 |
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Nc1ccc(CCC(O)c2ccccc2)cc1 |
|
| MolPort-000-002-486 |
0.60 |
N[C@@H](Cc1ccc(cc1)C#N)C(O)=O |
|
| MolPort-004-350-206 |
0.60 |
Cc1cc(C)c(CC(N)C(O)=O)c(C)c1 |
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| MolPort-003-794-834 |
0.60 |
Cc1ccc(C[C@@H](N)C(O)=O)c(C)c1 |
|
| MolPort-008-268-017 |
0.60 |
C[C@](N)(Cc1ccc(cc1)-c1ccccc1)C(O)=O |
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| MolPort-003-794-833 |
0.60 |
Cc1ccc(C[C@H](N)C(O)=O)c(C)c1 |
|
| MolPort-001-758-821 |
0.60 |
N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |
|
| MolPort-003-795-068 |
0.60 |
NC(Cc1ccc(cc1)-c1ccccc1)C(O)=O |
|
| MolPort-001-766-755 |
0.60 |
CC(C)(C)Cc1ccccc1 |
|
| MolPort-002-053-756 |
0.60 |
Cc1cccc(c1)C1CCNC1 |
|
| MolPort-001-794-123 |
0.60 |
Cc1ccc(cc1)C(CN)c1ccccc1 |
|
| MolPort-001-794-395 |
0.60 |
CC(C)Cc1ccc(cc1)C(O)=O |
|
| MolPort-002-029-690 |
0.60 |
NC1(CC1)c1ccccc1 |
|
| MolPort-002-043-214 |
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CC(C)(Cc1ccccc1)NC=O |
|
| MolPort-046-665-074 |
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C[C@@H](CO)CC(C)c1ccccc1 |
|
| MolPort-002-054-173 |
0.60 |
Cl.COc1ccc(cc1)C(C)(O)CN |
|
| MolPort-001-793-223 |
0.60 |
COC(CCC#N)c1ccccc1 |
|
| MolPort-046-651-041 |
0.60 |
C[C@H](CO)CC(C)(C)c1ccccc1 |
|
| MolPort-001-792-191 |
0.60 |
CNC[C@H](O)c1cccc(O)c1 |
|
| MolPort-027-807-729 |
0.60 |
N[C@@H]1CCCC[C@H]1c1ccccc1 |
|
| MolPort-001-793-327 |
0.60 |
CC(O)CCc1ccccc1 |
|
| MolPort-011-914-185 |
0.60 |
CCNC(CC)Cc1ccccc1 |
|
| MolPort-002-466-648 |
0.60 |
CC(=O)C(N)Cc1ccccc1 |
|
| MolPort-001-791-422 |
0.60 |
OCCCCc1ccccc1 |
|
| MolPort-001-787-029 |
0.60 |
CCC(C)(C)c1ccccc1 |
|
| MolPort-001-783-440 |
0.60 |
CNCC(O)c1cccc(O)c1 |
|
| MolPort-011-957-278 |
0.60 |
CCNCC(CC)c1ccccc1 |
|
| MolPort-046-668-077 |
0.60 |
CC(C)C([C@H](C)CN)c1ccccc1 |
|
| MolPort-046-672-034 |
0.60 |
C[C@@H](N)C(C(F)F)c1ccccc1 |
|
| MolPort-046-675-664 |
0.60 |
Cc1cc(C)cc(CC23CC(N)(C2)C3)c1 |
|
| MolPort-046-676-101 |
0.60 |
Cc1cc(C)cc(CC23CC(CN)(C2)C3)c1 |
|
| MolPort-046-677-265 |
0.60 |
Cl.N[C@H]1CCC[C@H]1c1ccccc1 |
|
| MolPort-046-677-018 |
0.60 |
Cc1cccc(CC23CC(N)(C2)C3)c1 |
|
| MolPort-006-127-696 |
0.60 |
CC(c1ccccc1)C(C)(C)C |
|
| MolPort-016-634-461 |
0.60 |
NC1CCCCC1c1ccccc1 |
|
| MolPort-046-426-872 |
0.60 |
OS(O)(=O)=O.NC1CC1c1ccccc1.NC1CC1c1ccccc1 |
|
| MolPort-006-140-442 |
0.60 |
CC(CCO)(CCO)c1ccccc1 |
|
| MolPort-021-945-721 |
0.60 |
NCC(O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F |
|
| MolPort-013-402-294 |
0.60 |
CCC(N)c1cccc2ccccc12 |
|
| MolPort-014-000-443 |
0.60 |
CCCc1ccc(cc1)C(O)C(F)(F)F |
|
| MolPort-020-014-059 |
0.60 |
Cl.CC(C)[C@H](N)c1ccccc1 |
|
| MolPort-020-168-168 |
0.60 |
Cl.COC(CN)c1ccc(Cl)cc1 |
|
| MolPort-006-126-342 |
0.60 |
OCC1(CC1)c1ccccc1 |
|
| MolPort-039-136-793 |
0.60 |
Cl.CC(C)(C)[C@H](N)c1ccccc1 |
|
| MolPort-038-948-196 |
0.60 |
Cl.N[C@@H]1CCC[C@H]1c1ccccc1 |
|
| MolPort-006-725-853 |
0.60 |
Cl.NC(CC(O)=O)Cc1ccccc1 |
|
| MolPort-008-491-936 |
0.60 |
CC(C)C(CN)c1ccc(Cl)cc1 |
|
| MolPort-033-355-980 |
0.60 |
Cl.CNC(C)Cc1ccccc1C |
|
| MolPort-035-385-948 |
0.60 |
Cl.NC1Cc2ccccc12 |
|
| MolPort-008-491-914 |
0.60 |
CCC(CN)c1ccc(Cl)cc1 |
|
| MolPort-027-545-428 |
0.60 |
CC(O)(CCN)Cc1ccccc1 |
|
| MolPort-035-765-360 |
0.60 |
Cl.Cc1ccccc1[C@@H]1C[C@H]1N |
|
| MolPort-008-507-489 |
0.60 |
Cc1cccc(CC(C)(C)O)c1 |
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| MolPort-035-769-780 |
0.60 |
Cl.NCC1(CCOCC1)c1ccccc1 |
|
| MolPort-029-006-319 |
0.60 |
OCc1ccccc1C1CCC1 |
|
| MCULE-3563693636 |
0.60 |
C1OC2=C(C=CC(O)=C2C)C(=O)C1C1=CC=C(O)C=C1 |
|
| MolPort-006-704-660 |
0.60 |
Cl.CCC(N)c1ccccc1 |
|
| MCULE-1744197965 |
0.60 |
O1C2C=CC(=CC=2[C@@H]2CCC[C@@H]2[C@H]1C1=CC=C(C=C1)O)O |
|
| MolPort-028-984-161 |
0.60 |
CCC(C(C)CN)c1ccccc1 |
|
| MCULE-1139388494 |
0.60 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1 |
|
| MolPort-006-345-552 |
0.60 |
NCC(C1CCCC1)c1ccccc1 |
|
| MCULE-6392513488 |
0.60 |
C1(O)C=C2O[C@H](C3C=CC(O)=C(C/C=C(\C)/C)C=3)CCC2=CC=1 |
|
| MolPort-021-784-829 |
0.60 |
Cl.CC(C)C(N)c1ccccc1 |
|
| MCULE-5351025146 |
0.60 |
COC(C1=CC=C(OC(CCC2=CC(OC)=C(OC)C(OC)=C2)=O)C=C1)=O |
|
| MolPort-021-783-756 |
0.60 |
Cl.CC(C)[C@@H](N)c1ccccc1 |
|
| MCULE-9688299119 |
0.60 |
C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=C(Cl)C=1)Cl |
|
| MolPort-020-418-721 |
0.60 |
Cc1ccc(cc1F)C(O)CN |
|
| MCULE-5323328947 |
0.60 |
O1C2=CC(OC)=CC(OC)=C2[C@]2(O)[C@H](O)[C@H](C(OC)=O)[C@@H](C3=CC=CC=C3)[C@]12C1=CC=C(OC)C=C1 |
|
| MolPort-028-951-631 |
0.60 |
Cl.CC(C)C(Cc1ccccc1)NN |
|
| MCULE-2885326245 |
0.60 |
O=C1C2=CC3CCOC=3C=C2OCCC1 |
|
| MolPort-046-678-529 |
0.60 |
Cc1cccc(CC23CC(CN)(C2)C3)c1 |
|
| MCULE-5316080035 |
0.60 |
O1C2=CC(O)=CC(OC)=C2[C@]2(O)[C@H](O)[C@H](C(OC)=O)[C@@H](C3=CC=CC=C3)[C@]12C1=CC=C(OC)C=C1 |
|
| MolPort-002-129-866 |
0.60 |
CC(Cc1ccccc1)NC=O |
|
| MCULE-1405836247 |
0.60 |
C1(O)C=C2OCC(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1 |
|
| MolPort-000-000-778 |
0.60 |
Cl.COc1ccc(cc1)C(O)CN |
|
