MCULE-6398218625 |
0.76 |
C1C2=C(C(=O)C3=C(C2=O)C(O)=C2C([C@@H](O)C[C@@](C(C)=O)(O)C2)=C3O)C=CC=1
|
|
MCULE-5809705782 |
0.76 |
O=C1C2C(C(=O)C3C(=C4C(=C(O)C1=3)[C@@H](O)C[C@@](C(=O)C)(O)C4)O)=CC=CC=2
|
|
MolPort-044-562-318 |
0.76 |
CC(=O)[C@@]1(O)C[C@H](O)C2=C(O)C3=C(C(O)=C2C1)C(=O)C1=CC=CC=C1C3=O
|
|
MolPort-044-637-562 |
0.74 |
CC1=CC(O)=CC2=CC3=C(C(=O)CC[C@@H]3O)C(O)=C12
|
|
MCULE-4822181774 |
0.74 |
C1(O)C=C2C=C3[C@@H](O)CCC(=O)C3=C(O)C2=C(C)C=1
|
|
MolPort-046-158-450 |
0.73 |
O[C@@H]1CCC(=O)C2=C1C=CC=C2O
|
|
MolPort-022-398-788 |
0.71 |
CC1=C(CCO)C(C)=C(O)C2=C1C(=O)C(C)(C)C2
|
|
MolPort-028-610-100 |
0.70 |
CC1CC(=O)C2=C(C1O)C(O)=CC1=C2C(=O)C2=CC=CC(O)=C2C1=O
|
|
MolPort-035-706-175 |
0.69 |
CC1=C(CCO)C(C)=C(O)C2=C1C(=O)[C@](C)(CO)C2
|
|
MCULE-8171244487 |
0.69 |
C1(CCO)C(C)=C2C(=O)[C@](C)(CO)CC2=C(O)C=1C
|
|
MolPort-003-846-145 |
0.68 |
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](O)C3=C1O)C(C)=O)C2=O
|
|
MCULE-8508439131 |
0.68 |
O=C1C2C(C(=O)C3C(=C4C(=C(O)C1=3)C[C@](C(=O)C)(O)C[C@@H]4O)O)=C(OC)C=CC=2
|
|
MolPort-003-847-030 |
0.67 |
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](O)C3=C1O)C(=O)CO)C2=O
|
|
MolPort-001-739-528 |
0.67 |
CC(=O)C1=C(O)C=C2CC(O)CC(=O)C2=C1C
|
|
MolPort-004-787-161 |
0.67 |
OC(=O)C1=C2CCC(=O)C2=C(O)C(O)=C1
|
|
MCULE-8487314958 |
0.67 |
O=C1C2C(C(=O)C3C(=C4C(=C(O)C1=3)C[C@@](O)(C(=O)CO)C[C@H]4O)O)=C(OC)C=CC=2
|
|
MCULE-8450908813 |
0.67 |
O(C)C1=C2C(=O)C3C(O)=C4[C@@H](O)C[C@](O)(C(=O)CO)CC4=C(O)C=3C(=O)C2=CC=C1
|
|
MCULE-5887410327 |
0.67 |
C1(=O)C2=C(C(C(O)=O)=CC(O)=C2O)CC1
|
|
MCULE-5768810188 |
0.67 |
C1(C(=C2C(=CC=1O)CC(O)CC2=O)C)C(=O)C
|
|
MCULE-3055669086 |
0.67 |
C12CCCCC1=C(C=O)C=C(C(=O)O)C=2O
|
|
MolPort-001-739-465 |
0.66 |
COC1=C(CO)C(O)=C2C(=O)CCC(O)C2=C1
|
|
MolPort-039-338-879 |
0.66 |
CC(C)C1=CC2=C(C=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1[C@@H](O)C2=O
|
|
MCULE-9066768050 |
0.66 |
C1(C(=C2C(=CC=1OC)C(O)CCC2=O)O)CO
|
|
MolPort-002-806-715 |
0.65 |
CC(=O)[C@@]1(O)C[C@H](OC(C)(C)C)C2=C(O)C3=C(C(O)=C2C1)C(=O)C1=C(C=CC=C1)C3=O
|
|
MolPort-002-918-499 |
0.65 |
CC1=C(C)C(O)=C(C=C1)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MolPort-035-691-155 |
0.65 |
CC1=CC=C2C(=O)CCCC2=C1O
|
|
MolPort-046-764-497 |
0.65 |
C[C@]12CC[C@H]3[C@@H](CCC4=C(C(O)=O)C(O)=CC=C34)[C@@H]1CC[C@@H]2O
|
|
MCULE-9946852877 |
0.65 |
C1(O)(C(=O)C2C(=CC=CC=2)C1=O)C1=CC=C(C)C(C)=C1O
|
|
MCULE-4048610533 |
0.65 |
C1(C(O)=O)C2CCCCC=2C=C(C(O)=O)C=1O
|
|
MCULE-2210298770 |
0.65 |
O=C1C2C=CC(=C(O)C=2CCC1)C
|
|
MCULE-3739965645 |
0.65 |
O=C1C2C(O)=C3CC(CCC3=C(O)C=2C(C2C=CC=CC=21)=O)C(C)=O
|
|
MCULE-4074142300 |
0.65 |
OC(C1C=CC2CCCCC=2C=1O)=O
|
|
MCULE-5622533956 |
0.65 |
C1C=C2C(C(C(C2=CC=1)=O)(O)C1C(O)=CC(C)=C(C)C=1)=O
|
|
MCULE-8418521945 |
0.65 |
CC1([C@@H]2CC(C3=C([C@@]2(C)CCC1)C(O)=C(O)C(C(C)C)=C3)=O)C
|
|
MolPort-028-949-970 |
0.65 |
OC(=O)C1=C(O)C2=C(CCCC2)C=C1
|
|
MolPort-009-675-280 |
0.65 |
CC1=C(C)C=C(C(O)=C1)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MolPort-003-804-191 |
0.65 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2=O
|
|
MolPort-008-003-170 |
0.64 |
CC(C)C1=CC=C(C)C(=C1O)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MCULE-3988958812 |
0.64 |
C1(O)(C(=O)C2C(=CC=CC=2)C1=O)C1C(C)=CC=C(C(C)C)C=1O
|
|
MolPort-035-706-501 |
0.64 |
CC1=CC2=C(C(=O)C(C)(C)[C@@H]2O)C(C)=C1CCO
|
|
MolPort-035-706-496 |
0.63 |
CC1=C(CCO)C(C)=C2C(=C1)[C@@H](O)[C@](C)(CO)C2=O
|
|
MCULE-3677913552 |
0.63 |
C1(CCO)C(C)=C2C(=O)[C@](CO)(C)[C@H](O)C2=CC=1C
|
|
MCULE-6504405710 |
0.63 |
C1C(=C2C(=O)C[C@H](O)[C@]3([H])C2=C(C=1)C1C2=C(C(=O)CC[C@]23O)C(O)=CC=1)O
|
|
MCULE-4845337264 |
0.63 |
C1C=C2C(C(C3=C(C2=O)C2C(O)CC(C)CC=2C=C3)O)=C(O)C=1
|
|
MolPort-004-964-394 |
0.63 |
O[C@H]1CC(=O)C2=C(O)C=CC3=C2[C@@H]1[C@]1(O)CCC(=O)C2=C(O)C=CC3=C12
|
|
MolPort-001-739-485 |
0.63 |
CC1CC(O)C2=C3C(=O)C4=CC=CC(O)=C4C(O)C3=CC=C2C1
|
|
MolPort-019-936-838 |
0.63 |
CC(C)C1=C(O)C=C2C(=C1)C(=O)C[C@H]1C(C)(C)CCC[C@]21C
|
|
MolPort-002-806-700 |
0.62 |
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](O)C3=C1O)C(=O)COC(C)=O)C2=O
|
|
MolPort-002-918-492 |
0.62 |
CC(C)(C)C1=CC=CC(=C1O)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MCULE-5750749454 |
0.62 |
C12C(O)=C3C[C@@](O)(C(=O)COC(C)=O)C[C@H](O)C3=C(O)C=1C(C1C(=CC=CC=1C2=O)OC)=O
|
|
MCULE-1043222181 |
0.62 |
C1(O)(C(=O)C2C(=CC=CC=2)C1=O)C1=CC=CC(C(C)(C)C)=C1O
|
|
MCULE-9206988984 |
0.62 |
C12C=CC=CC=1C(=O)C1C(C3=CC=C(OC)C=C3)C(C3C=CC=CC=3)C(O)(C3C=CC=CC=3)C21O
|
|
MCULE-4153752963 |
0.62 |
C12C=CC=CC=1C(=O)C1C(C3=CC=CC=C3)C(C3C=CC=CC=3)C(O)(C3C=CC=CC=3)C21O
|
|
MCULE-3380616550 |
0.62 |
C1(C(O)=O)=CC2CCCCC=2C(C)=C1O
|
|
MCULE-9824211897 |
0.62 |
CC1=C(O)C(C2(C(=O)C3=C(C=CC=C3)C2=O)O)=CC=C1
|
|
MolPort-001-739-701 |
0.62 |
CC1(O)CC(=O)C2=C3C(=O)C4=CC=CC(O)=C4C(=O)C3=CC=C2C1
|
|
MolPort-001-842-789 |
0.62 |
CC1=CC=CC(=C1O)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MolPort-046-689-289 |
0.61 |
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(CCC3=C1O)C(=O)CO)C2=O
|
|
MolPort-020-002-885 |
0.61 |
CC(=O)C1=C(O)C2=C(CCCC2)C=C1
|
|
MolPort-003-996-732 |
0.61 |
CC1=CC=C(O)C(=C1)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MolPort-002-918-497 |
0.61 |
CC1=CC(=C(O)C(C)=C1)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MCULE-5999302017 |
0.61 |
C12C=CC=CC=1C(=O)C1C(C3=CC=C(OC)C=C3)C(C3C=CC(OC)=CC=3)C(O)(C3C=CC(OC)=CC=3)C21O
|
|
MCULE-2907302923 |
0.61 |
CC1=CC(C2(C(=O)C3=C(C=CC=C3)C2=O)O)=C(O)C=C1
|
|
MCULE-7065217467 |
0.61 |
C1(O)(C(=O)C2C(=CC=CC=2)C1=O)C1=CC(=CC(C)=C1O)C
|
|
MCULE-9495693297 |
0.61 |
CC1C2=C(C=CC(O)=C2C(=O)C1)C
|
|
MCULE-3435930026 |
0.61 |
C(O)(=O)C1=C(O)C=CC=C1CCC1=CC=C(CCCCCCC)C=C1
|
|
MCULE-1118959302 |
0.61 |
C1(O)(C(=O)C2C(=CC=CC=2)C1=O)C1C(O)=CC=C(CC)C=1
|
|
MCULE-1591574086 |
0.61 |
OC(C1=C(O)C=C2C(CCCC2)=C1)=O
|
|
MCULE-1099432500 |
0.61 |
C1(C=C(C2CCCCC=2C=1)O)C(OC)=O
|
|
MCULE-4488359745 |
0.61 |
COC(C1C=CC2CCCCC=2C=1O)=O
|
|
MCULE-5972850466 |
0.61 |
C1C2=C(C(C(O)C2C(C)C)=O)C(O)=C(C=1C)C1=C(C)C=C2C(C(C)C)C(O)C(=O)C2=C1O
|
|
MCULE-9008426822 |
0.61 |
C12C(O)=C(Cl)C(Cl)=C(O)C=1C(C1CC3=C(C=CC=C3)CC1C2=O)=O
|
|
MolPort-035-789-680 |
0.61 |
CCCCCCCC1=CC=C(CCC2=C(C(O)=O)C(O)=CC=C2)C=C1
|
|
MolPort-002-471-246 |
0.61 |
CC1CC(=O)C2=C1C(C)=CC=C2O
|
|
MolPort-002-918-493 |
0.61 |
CCC1=CC(=C(O)C=C1)C1(O)C(=O)C2=CC=CC=C2C1=O
|
|
MolPort-016-634-607 |
0.61 |
OC(=O)C1=CC2=C(CCCC2)C=C1O
|
|
MolPort-022-382-660 |
0.61 |
COC(=O)C1=CC2=C(CCCC2)C(O)=C1
|
|
MolPort-038-359-669 |
0.60 |
OC(=O)C1=CC=C2CCCC2=C1O
|
|
MolPort-046-765-428 |
0.60 |
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](O)C3=C1O)C(O)CO)C2=O
|
|
MolPort-046-690-408 |
0.60 |
COC1=CC=C(C=C1)C(OCC(=O)[C@@]1(O)C[C@H](O)C2=C(O)C3=C(C(O)=C2C1)C(=O)C1=C(C(OC)=CC=C1)C3=O)(C1=CC=CC=C1)C1=CC=CC=C1
|
|
MolPort-039-338-583 |
0.60 |
CC(C)C1=CC(C=O)=C(C=C1O)[C@@]1(C)CCCC(C)(C)C1C=O
|
|
MolPort-044-875-300 |
0.60 |
Cl.CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)C4=C(O)C=CC=C4[C@@]3(C)O)C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O
|
|
MCULE-1909608496 |
0.60 |
OC(C1=C(O)C2=C(CCC2)C=C1)=O
|
|
MCULE-1162163176 |
0.60 |
OC1=C2C(CCCC2)=CC(C=O)=C1
|
|
MCULE-3207636917 |
0.60 |
C1(=O)C2=C(C(C)=CC=C2O)CC1
|
|
MCULE-9823632696 |
0.60 |
C1(O)(C2=C(O)C=CC3=CC=CC=C23)C(=O)C2C(=CC=CC=2)C1=O
|
|
MCULE-7278805336 |
0.60 |
C12C(=O)CCC=1C=CC(C)=C2O
|
|