| MCULE-7615488568 |
1 |
C1(OC)C(O)=C2[C@@]3(O[C@H](COC(C4C=C(O)C(O)=C(O)C=4)=O)[C@@H](O)[C@H](O)[C@]3(OC(=O)C2=CC=1O)[H])[H]
|
|
| MCULE-6446812002 |
1 |
C12C(O)=C(OC)C(=CC=1C(=O)O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)O
|
|
| MCULE-4906787678 |
1 |
C1(C(=C2C(C(O[C@@]3([H])[C@@]2([H])O[C@H](CO)[C@@H](O)[C@@H]3O)=O)=CC=1O)O)OC
|
|
| MolPort-046-153-750 |
1 |
COC1=C(O)C=C2C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](COC(=O)C4=CC(O)=C(O)C(O)=C4)O[C@H]3C2=C1O
|
|
| MolPort-005-938-502 |
1 |
COC1=C(O)C2=C(C=C1O)C(=O)OC1C(O)C(O)C(CO)OC21
|
|
| MolPort-002-507-606 |
1 |
COC1=C(O)C2=C(C=C1O)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]21
|
|
| MolPort-009-653-458 |
1 |
O.COC1=C(O)C2=C(C=C1O)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]21
|
|
| MolPort-046-153-749 |
0.99 |
COC1=C(O)C=C2C(=O)O[C@@H]3[C@@H](OC(=O)C4=CC(O)=C(O)C(O)=C4)[C@H](O)[C@@H](CO)O[C@H]3C2=C1O
|
|
| MCULE-6080588477 |
0.99 |
C1(OC)C(O)=C2[C@@]3(O[C@H](CO)[C@@H](O)[C@H](OC(C4C=C(O)C(O)=C(O)C=4)=O)[C@]3(OC(=O)C2=CC=1O)[H])[H]
|
|
| MCULE-1420104540 |
0.94 |
C1(OC)C(OC)=C2[C@@]3(O[C@H](CO)[C@@H](O)[C@H](O)[C@]3(OC(=O)C2=CC=1OC)[H])[H]
|
|
| MolPort-039-052-427 |
0.94 |
COC1=C(OC)C(OC)=C2[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3OC(=O)C2=C1
|
|
| MCULE-2777004607 |
0.87 |
C12C(=O)O[C@]3([H])C[C@H](CCC)O[C@]3([H])C=1C=C(OC)C(OC)=C2O
|
|
| MolPort-001-739-518 |
0.87 |
CCC[C@H]1C[C@H]2OC(=O)C3=C(C=C(OC)C(OC)=C3O)[C@H]2O1
|
|
| MCULE-4432206889 |
0.83 |
C1(OC)C(OC(=O)C)=C2[C@@]3(O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@]3(OC(=O)C2=CC=1OC(=O)C)[H])[H]
|
|
| MCULE-9412696724 |
0.83 |
C12C(OC(C)=O)=C(OC)C(=CC=1C(=O)OC1C(C(OC(C)=O)C(COC(C)=O)OC12)OC(C)=O)OC(C)=O
|
|
| MolPort-035-706-487 |
0.83 |
COC1=C(OC(C)=O)C2=C(C=C1OC(C)=O)C(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@@H]21
|
|
| MolPort-027-564-205 |
0.76 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCCC2)=C1O
|
|
| MolPort-035-814-017 |
0.76 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCCC2)=C1O
|
|
| MolPort-044-431-854 |
0.76 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCCC2)=C1O
|
|
| MolPort-001-739-981 |
0.76 |
COC1=C(O)C=C2C(O)C(C)OC(=O)C2=C1O
|
|
| MolPort-005-944-212 |
0.76 |
COC1=C(O)C2=C(C=C1O)C(O)C(C)OC(=O)C1=C(O)C(OC)=C(O)C(O)=C1C(O)C(C)OC2=O
|
|
| MolPort-019-931-728 |
0.76 |
COC1=C(O)C=C2[C@H](O)[C@@H](C)OC(=O)C2=C1O
|
|
| MCULE-2835674638 |
0.76 |
C12C(O)=C(OC)C(=C(CN3CCCC3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-5904920929 |
0.76 |
C12C(O)=C(OC)C(=C(CN3CCCC3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-2913861683 |
0.76 |
C1(C=C2C(=C(O)C=1OC)C(=O)OC(C)C2O)O
|
|
| MCULE-6246056269 |
0.76 |
C1(C=C2C(=C(O)C=1OC)C(=O)O[C@H](C)[C@H]2O)O
|
|
| MCULE-4366689225 |
0.76 |
C1(=C(OC)C(=C2C(C(O)C(C)OC(=O)C3C(C(O)C(C)OC2=O)=C(O)C(O)=C(OC)C=3O)=C1)O)O
|
|
| MCULE-1335579906 |
0.76 |
C12C(O)=C(OC)C(=C(CN3CCCCC3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-5346265074 |
0.76 |
C12C(O)=C(OC)C(=C(CN3CCC(CC3)C)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-2218163562 |
0.76 |
C12C(O)=C(OC)C(=C(CN3CCC(CC3)C)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MolPort-027-564-423 |
0.76 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCC(C)CC2)=C1O
|
|
| MolPort-044-431-853 |
0.76 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCC(C)CC2)=C1O
|
|
| MolPort-027-564-349 |
0.76 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCCCC2)=C1O
|
|
| MolPort-027-564-408 |
0.75 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCC(CC3=CC=CC=C3)CC2)=C1O
|
|
| MolPort-046-594-820 |
0.75 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=CC=C2)=C1O
|
|
| MolPort-046-697-376 |
0.75 |
CC(C)C12CCC3(C)OC4=CC(O)=C5C(=O)OC(C)C(OC(C)=O)C5=C4CC3(O)C1(C)CCC(=O)O2
|
|
| MolPort-027-564-118 |
0.75 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCOCC2)=C1O
|
|
| MolPort-027-564-127 |
0.75 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCCC(C)C2)=C1O
|
|
| MolPort-044-431-860 |
0.75 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCCC(C)C2)=C1O
|
|
| MolPort-027-564-666 |
0.75 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=CC=C2)=C1O
|
|
| MolPort-044-431-852 |
0.75 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCC(CC3=CC=CC=C3)CC2)=C1O
|
|
| MCULE-5820672663 |
0.75 |
C12CC3(O)C(C)(OC1=CC(O)=C1C(=O)OC(C)C(C=21)OC(C)=O)CCC1(C(C)C)OC(=O)CCC31C
|
|
| MCULE-8280490299 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3=CC=CC=C3)C3=CC=CC=C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-5175912943 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCCC(C)C3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-8184145115 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCC(CC3)CC3=CC=CC=C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-6115000137 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCC(CC3)CC3C=CC=CC=3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-9097775470 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCOCC3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-4722299112 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3C=CC=CC=3)C3C=CC=CC=3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-4013943560 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCCC(C)C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-2978402819 |
0.75 |
C12C(O)=C(OC)C(=C(CN3CCSCC3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MolPort-027-564-654 |
0.75 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCSCC2)=C1O
|
|
| MolPort-039-338-788 |
0.74 |
OC(=O)C[C@H](C1[C@H](OC(=O)C2=C1C(O)=C(O)C(O)=C2)C(O)=O)C(O)=O
|
|
| MolPort-016-584-264 |
0.74 |
COC1=CC2=C(C=C1OC)C1(CCCC1)COC2=O
|
|
| MCULE-2261900172 |
0.74 |
C12C=C(O)C(O)=C(O)C=1C([C@H](OC2=O)C(O)=O)[C@H](C(O)=O)CC(O)=O
|
|
| MCULE-8364430879 |
0.74 |
C12=CC(OC)=C(C=C1C1(COC2=O)CCCC1)OC
|
|
| MCULE-6627529154 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CC4(CC3CC(C4)(C)C)C)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-9231578845 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CC3C=CC=C(Cl)C=3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-5487625703 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CC3C=CC=C(Cl)C=3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-4129779584 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CC3=CC=C4C(OCO4)=C3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-9727618109 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCC(C4C=CC=CC=4)C3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-3676720875 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCC(C4C=CC=CC=4)C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-2142421849 |
0.74 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CC3=CC=C4C(OCO4)=C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MolPort-044-431-856 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CC3(C)CC2CC(C)(C)C3)=C1O
|
|
| MolPort-027-564-083 |
0.74 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CC3(C)CC2CC(C)(C)C3)=C1O
|
|
| MolPort-046-594-823 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC3=CC(Cl)=CC=C3)CC2)=C1O
|
|
| MolPort-027-564-511 |
0.74 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC3=CC(Cl)=CC=C3)CC2)=C1O
|
|
| MolPort-035-814-018 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC3=CC(Cl)=CC=C3)CC2)=C1O
|
|
| MolPort-035-814-014 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC3=CC=C4OCOC4=C3)CC2)=C1O
|
|
| MolPort-046-594-822 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC3=CC=C4OCOC4=C3)CC2)=C1O
|
|
| MolPort-027-564-176 |
0.74 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC3=CC=C4OCOC4=C3)CC2)=C1O
|
|
| MolPort-044-431-855 |
0.74 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCC(C2)C2=CC=CC=C2)=C1O
|
|
| MolPort-027-564-771 |
0.74 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCC(C2)C2=CC=CC=C2)=C1O
|
|
| MolPort-005-944-040 |
0.73 |
COC1=CC2=C(C(O)=C1)C(=O)OC(C)C2O
|
|
| MCULE-6300759633 |
0.73 |
C1(OC)=CC(O)=C2C(=C1)C(O)C(C)OC2=O
|
|
| MolPort-001-740-007 |
0.72 |
COC1=C(O)C2=C(C=C1O)C(OC1=CC3=C(C(=O)OC(C)C3O)C(O)=C1OC)C(C)OC2=O
|
|
| MolPort-035-705-786 |
0.72 |
COC1=CC=C(CC[C@H]2CC3=C(C(=O)O2)C(O)=CC(O)=C3)C=C1
|
|
| MolPort-005-944-340 |
0.72 |
COC1=C(O)C=C2C(=O)OC(C(C)O)C2=C1O
|
|
| MCULE-6530426654 |
0.72 |
C12C(O)=C(OC)C(OC3C(OC(=O)C4C(O)=C(OC)C(=CC=43)O)C)=CC=1C(O)C(C)OC2=O
|
|
| MCULE-9994058032 |
0.72 |
C1(O)C=C2C[C@]([H])(CCC3C=CC(OC)=CC=3)OC(=O)C2=C(O)C=1
|
|
| MCULE-6728867253 |
0.72 |
C1(OC)C(=C2C(C(=O)OC2C(O)C)=CC=1O)O
|
|
| MCULE-3197564551 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CCOC3C=CC=CC=3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-2841977642 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3C=CC=CC=3)C3C=CC(=CC=3)Cl)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-7267086805 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CCOC3C=CC=CC=3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-8151175124 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3=CC=CC=C3)C3C=CC(=CC=3)Cl)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-7148562032 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3C=CC(=CC=3)F)C3C=CC(=CC=3)F)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-9519416292 |
0.72 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C(C3=CC=C(C=C3)F)C3=CC=C(C=C3)F)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MolPort-027-564-537 |
0.72 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-046-594-825 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-035-814-036 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-044-431-850 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CCOC3=CC=CC=C3)CC2)=C1O
|
|
| MolPort-027-564-678 |
0.72 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CCOC3=CC=CC=C3)CC2)=C1O
|
|
| MolPort-035-814-008 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CCOC3=CC=CC=C3)CC2)=C1O
|
|
| MolPort-027-564-113 |
0.72 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C(C2=CC=C(F)C=C2)C2=CC=C(F)C=C2)=C1O
|
|
| MolPort-035-814-013 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC2)C(C2=CC=C(F)C=C2)C2=CC=C(F)C=C2)=C1O
|
|
| MolPort-046-594-821 |
0.72 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C(C2=CC=C(F)C=C2)C2=CC=C(F)C=C2)=C1O
|
|
| MolPort-001-741-530 |
0.71 |
OCC1OC(C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O)C1=C(O)C(C(=O)C2=CC=C(O)C=C2)=C(O)C=C1O
|
|
| MCULE-4316808464 |
0.71 |
O(C1C(C(C(CO)OC1C1C(O)=CC(=C(C(=O)C2C=CC(O)=CC=2)C=1O)O)O)O)C(=O)C1C=C(O)C(O)=C(O)C=1
|
|
| MolPort-035-814-023 |
0.70 |
COC1=C(C=CC=C1)N1CCN(CC2=C(O)C(OC)=C(O)C3=C2C(=O)OC2[C@@H](O)[C@H](O)[C@@H](CO)OC32)CC1
|
|
| MolPort-035-814-024 |
0.70 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC2)S(C)(=O)=O)=C1O
|
|
| MolPort-027-564-453 |
0.70 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)S(C)(=O)=O)=C1O
|
|
| MolPort-044-431-858 |
0.70 |
COC1=C(C=CC=C1)N1CCN(CC2=C(O)C(OC)=C(O)C3=C2C(=O)OC2C(O)C(O)C(CO)OC32)CC1
|
|
| MolPort-027-564-181 |
0.70 |
COC1=C(C=CC=C1)N1CCN(CC2=C(O)C(OC)=C(O)C3=C2C(=O)O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]32)CC1
|
|
| MolPort-035-705-790 |
0.70 |
COC1=CC=C(CC[C@H]2CC3=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC(O)=C3C(=O)O2)C=C1
|
|
| MolPort-044-431-859 |
0.70 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)S(C)(=O)=O)=C1O
|
|
| MolPort-006-668-476 |
0.70 |
CC(O)CCCCCCCCCC1CC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MCULE-2403206334 |
0.70 |
C1(=O)OC(CC2=CC(OC)=C(OC)C=C12)C(O)=O
|
|
| MCULE-1261867436 |
0.70 |
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2C[C@]([H])(CCC3C=CC(OC)=CC=3)OC(=O)C2=C(O)C=1
|
|
| MCULE-2622811400 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)S(C)(=O)=O)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-4746374864 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3=CC=CC=C3OC)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-8800685861 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC=CC=3OC)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-5612617269 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)S(C)(=O)=O)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-9302085165 |
0.70 |
C1C(O)=CC(=C2C(=O)OC(CC=12)CCCCCCCCCC(O)C)O
|
|
| MCULE-2393848543 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CCOC3C=CC=CC=3Cl)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-3547685519 |
0.70 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)CCOC3C=CC=CC=3Cl)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-2987954950 |
0.70 |
S(=O)(=O)(N(C)C)N1CCN(CC1)CC1=C(O)C(OC)=C(C2[C@]3([C@@]([H])([C@@H](O)[C@@H]([C@@H](CO)O3)O)OC(=O)C=21)[H])O
|
|
| MolPort-035-814-009 |
0.70 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CCOC3=C(Cl)C=CC=C3)CC2)=C1O
|
|
| MolPort-027-564-373 |
0.70 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CCOC3=C(Cl)C=CC=C3)CC2)=C1O
|
|
| MolPort-027-564-062 |
0.70 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)S(=O)(=O)N(C)C)=C1O
|
|
| MolPort-046-594-819 |
0.70 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CCOC3=C(Cl)C=CC=C3)CC2)=C1O
|
|
| MolPort-027-563-956 |
0.69 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C2=C(C)C=C(C)C=C2)=C1O
|
|
| MolPort-044-431-857 |
0.69 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-044-431-851 |
0.69 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C2=C(C)C=C(C)C=C2)=C1O
|
|
| MolPort-027-564-493 |
0.69 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-035-814-021 |
0.69 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC2)C2=CC=C(Cl)C=C2)=C1O
|
|
| MolPort-027-564-543 |
0.69 |
COC1=CC=CC(=C1)N1CCN(CC2=C(O)C(OC)=C(O)C3=C2C(=O)O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]32)CC1
|
|
| MCULE-5055389167 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC(=CC=3C)C)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-4273065940 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC(=CC=3)Cl)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-4367792202 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC(=CC=3)Cl)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-1851465996 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC(=CC=3C)C)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-8619281776 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3=CC=CC(OC)=C3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-9014854310 |
0.69 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC=C(OC)C=3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-6577549494 |
0.69 |
COC1C(O)=C(O)C=C(C(O[C@H]2[C@@H](C3=CC(O)=C(O)C(O)=C3)CC3=C(C(=CC(=C3)O)O)C2)=O)C=1
|
|
| MolPort-001-739-991 |
0.68 |
COC1=C(O)C(Cl)=C2C(O)C(C)OC(=O)C2=C1O
|
|
| MolPort-006-668-336 |
0.68 |
OC[C@H]1O[C@H]([C@H](OC(=O)C2=CC=C(O)C=C2)[C@@H](O)[C@@H]1O)C1=C(O)C(C(=O)C2=CC=C(O)C=C2)=C(O)C=C1O
|
|
| MCULE-7510047110 |
0.68 |
C1(C(Cl)=C2C(O)C(C)OC(=O)C2=C(O)C=1OC)O
|
|
| MCULE-8797108012 |
0.68 |
C(C1C=CC(O)=CC=1)(=O)O[C@@H]1[C@H]([C@@H]([C@@H](CO)O[C@H]1C1C(O)=CC(O)=C(C(C2C=CC(O)=CC=2)=O)C=1O)O)O
|
|
| MCULE-1055260882 |
0.68 |
C1=C(O)C=C2C(C(=O)OC(C)C2O)=C1O
|
|
| MCULE-1105649690 |
0.68 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3=CC=C(C(Cl)=C3)Cl)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-1582020891 |
0.68 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C=CC(=C(Cl)C=3)Cl)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MolPort-027-564-229 |
0.68 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C2=CC(Cl)=C(Cl)C=C2)=C1O
|
|
| MolPort-046-594-824 |
0.68 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)C2=CC(Cl)=C(Cl)C=C2)=C1O
|
|
| MolPort-046-153-054 |
0.67 |
COC1=CC=C(C=C1OC)C1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-005-944-290 |
0.67 |
COC1=C(Cl)C(O)=C2C(=O)OC(C)C(O)C2=C1
|
|
| MolPort-001-739-301 |
0.67 |
CC(O)CCCC1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MCULE-1468202024 |
0.67 |
C1(C=C2C(=C(O)C=1Cl)C(=O)OC(C)C2O)OC
|
|
| MCULE-3047447524 |
0.67 |
C1(OC)C=C([C@@H]2[C@@]3([H])CO[C@H](C4C=C(OC)C(O)=CC=4)[C@@]3(OC(=O)C)CO2)C=CC=1O
|
|
| MCULE-9289659937 |
0.67 |
C1C=C2C(C3OC43C(O)CC3(O)CC(C)CC(=O)C3C4(O)C2=O)=C(O)C=1
|
|
| MCULE-4414858012 |
0.67 |
C1(OC)C=C2C(=CC=1OC)C(C1C=CC(C(=O)OC)=CC=1)OC1CCCCC21
|
|
| MCULE-6017802316 |
0.67 |
C1C(O)=C2C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(=O)C4C=C(O)C(O)=C(O)C=4)O3)CCC(=O)C2=C(O)C=1
|
|
| MolPort-039-338-343 |
0.67 |
COC1=CC(=CC=C1O)[C@H]1OC[C@@H]2[C@H](OC[C@]12OC(C)=O)C1=CC(OC)=C(O)C=C1
|
|
| MolPort-002-744-773 |
0.67 |
COC(=O)C1=CC=C(C=C1)C1OC2CCCCC2C2=C1C=C(OC)C(OC)=C2
|
|
| MolPort-023-274-412 |
0.67 |
O[C@H]1[C@H](O)[C@@H](COC(=O)C2=CC(O)=C(O)C(O)=C2)O[C@@H](OC2CCC(=O)C3=C(O)C=CC(O)=C23)[C@@H]1O
|
|
| MolPort-001-739-519 |
0.67 |
CC1CC(=O)C2C(O)(C1)CC(O)C13OC1C1=C(O)C=CC=C1C(=O)C23O
|
|
| MolPort-027-564-180 |
0.66 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)C2=CC(Cl)=CC=C2C)=C1O
|
|
| MolPort-035-814-011 |
0.66 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC23)C(CN2CCN(CC2)C2=CC(Cl)=CC=C2C)=C1O
|
|
| MCULE-4947432257 |
0.66 |
C1(C(OC)=O)(C(OC)=O)CC2=CC(=CC=C2C(=O)O1)OC
|
|
| MCULE-1434244842 |
0.66 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3C(C)=CC=C(Cl)C=3)C=1C(O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)=O)O
|
|
| MCULE-2399147762 |
0.66 |
C12C(O)=C(OC)C(=C(CN3CCN(CC3)C3=C(C)C=CC(Cl)=C3)C=1C(OC1C(C(O)C(CO)OC12)O)=O)O
|
|
| MCULE-9934713501 |
0.66 |
C12=C(OC)C=C(C=C1C(OC2=O)CCCCCCCCCCCC)OC
|
|
| MolPort-002-845-847 |
0.66 |
CCCCCCCCCCCCC1OC(=O)C2=C1C=C(OC)C=C2OC
|
|
| MolPort-001-739-384 |
0.65 |
COC1=CC(O)=C2C(O)=C3C(=O)O[C@H](C)CC3=CC2=C1O
|
|
| MolPort-001-890-649 |
0.65 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=C(O)C=C(O)C=C1)OC2=O
|
|
| MolPort-000-723-221 |
0.65 |
COC1=C2C(CCCCC[C@H](O)CCC[C@H](C)OC2=O)=CC(O)=C1
|
|
| MolPort-002-526-557 |
0.65 |
COC1=C2C(CCCCC[C@@H](O)CCC[C@H](C)OC2=O)=CC(O)=C1
|
|
| MCULE-5595713477 |
0.65 |
C12C(C[C@H](OC1=O)C)=CC1=C(C(O)=CC(OC)=C1O)C=2O
|
|
| MCULE-7703475146 |
0.65 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=C(C=C1O)O
|
|
| MCULE-5320002126 |
0.65 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(O)C(=CC=1O)O
|
|
| MCULE-8789244515 |
0.65 |
C1(C(OC)=O)(C(OC)=O)CC2=CC=C(OC)C=C2C(=O)O1
|
|
| MCULE-1802859906 |
0.65 |
C12([H])C3C=C(OC)C=C(O)C=3C(=O)OC(C)CC=CC(=O)C(O)C(O)CC1([H])O2
|
|
| MCULE-5301015152 |
0.65 |
C1(=O)O[C@@H](C)CCC[C@H](CCCCCC2C=C(C=C(OC)C1=2)O)O
|
|
| MCULE-8057359874 |
0.65 |
C1(=O)O[C@@H](C)CCC[C@@H](CCCCCC2C=C(C=C(OC)C1=2)O)O
|
|
| MCULE-3435273442 |
0.65 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=CC(=CC=1O)OC
|
|
| MCULE-8946091649 |
0.65 |
O[C@@H]1[C@H]([C@H](O)[C@H](O[C@H]1C1=C(O)C=C(C(=C1O)C(OC)=O)CC/C=C\C=C/CCC)CO)O
|
|
| MCULE-9721139298 |
0.65 |
S(=O)(=O)(C1C=CC(=CC=1)C)N1CCN(CC1)CC1=C(O)C(OC)=C(C2[C@]3([C@@]([H])([C@@H](O)[C@@H]([C@@H](CO)O3)O)OC(=O)C=21)[H])O
|
|
| MCULE-4633429411 |
0.65 |
S(=O)(=O)(C1C=CC(=CC=1)C)N1CCN(CC1)CC1=C(O)C(OC)=C(C2C3(C([H])(C(O)C(C(CO)O3)O)OC(=O)C=21)[H])O
|
|
| MCULE-5268436722 |
0.65 |
C1C(=C2C(OC(C(C2=C(C)C=1OC)C)(CO)O)=O)O
|
|
| MCULE-4429228961 |
0.65 |
C12C(O)=CC=CC=1C[C@H](C1=CC=C(OC)C(O)=C1)OC2=O
|
|
| MCULE-1429630102 |
0.65 |
COC1=CC=C(C2OC(C3=C(C=CC=C3O)C2)=O)C=C1O
|
|
| MolPort-005-944-380 |
0.65 |
CCC\C=C/C=C\CCC1=C(C(=O)OC)C(O)=C([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(O)=C1
|
|
| MolPort-046-594-826 |
0.65 |
COC1=C(O)C2=C(C(=O)OC3C(O)C(O)C(CO)OC23)C(CN2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)=C1O
|
|
| MolPort-035-700-694 |
0.65 |
COC1=C(O)C2=C(C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)=C1O
|
|
| MolPort-044-562-482 |
0.65 |
COC1=C(O)C2=C(C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]23)C(CN2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)=C1O
|
|
| MolPort-046-697-309 |
0.65 |
COC1=CC(O)=C2C(=O)OC(O)(CO)C(C)C2=C1C
|
|
| MolPort-042-681-564 |
0.65 |
COC1=C(O)C=C(C=C1)[C@@H]1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-042-681-563 |
0.65 |
COC1=C(O)C=C(C=C1)[C@H]1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-028-748-972 |
0.65 |
COC1=CC=C(C=C1O)C1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-002-508-435 |
0.65 |
COC1=C(OC)C=C2C(COCC22CCCC2)=C1
|
|
| MolPort-021-804-746 |
0.64 |
COC1=C2C(CCCCCCCC(C)OC2=O)=CC(O)=C1
|
|
| MolPort-039-337-135 |
0.64 |
COC1=CC(O)=CC2=C1C(=O)O[C@@H](C)CCCCCCC2
|
|
| MolPort-002-816-895 |
0.64 |
COC1=CC=CC(C(O)C2OC(=O)C3=C2C=CC=C3)=C1OC
|
|
| MolPort-001-739-240 |
0.64 |
CC(=O)CCCC1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-042-675-191 |
0.64 |
C[C@H]1OC(=O)C2=C([C@H]1OC(C)=O)C1=C(O[C@@]3(C)[C@@H](O)C[C@H]4C(C)(C)C(=O)C=C[C@]4(C)[C@@H]3C1)C=C2O
|
|
| MCULE-2448525571 |
0.64 |
C1C(OC)=C2C(=O)OC(C)CCCCCCCC2=CC=1O
|
|
| MCULE-1641533460 |
0.64 |
C1C(OC)=C2C(=O)O[C@@H](C)CCCCCCCC2=CC=1O
|
|
| MCULE-5413720456 |
0.64 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C(C)=CC(=CC=1O)C
|
|
| MCULE-8342979705 |
0.64 |
C1(C(OC)=O)(C(OC)=O)CC2=CC=CC(OC)=C2C(=O)O1
|
|
| MCULE-4935479142 |
0.64 |
C1(C(O)C2C=CC=C(OC)C=2OC)C2C=CC=CC=2C(=O)O1
|
|
| MCULE-5834716652 |
0.64 |
C1=CC=C2C(C(=O)OC(CCCC(C)=O)C2)=C1O
|
|
| MCULE-6855430658 |
0.64 |
O1C2C1C1C=CC(OC)=C(OC)C=1CCC2
|
|
| MCULE-9566890994 |
0.64 |
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 |
0.64 |
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-6619628987 |
0.64 |
O=C(C1OC(=O)C2=C(C=CC=C2)C1)OCC1=CC2=C(OCO2)C=C1
|
|
| MCULE-9135189480 |
0.64 |
C12=C(OC)C(OC)=CC=C1C(OC2=O)CC(=O)C1=CC=C(C=C1OC)OC
|
|
| MolPort-039-338-958 |
0.64 |
COC1=CC(=CC(O)=C1O)C(=O)O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC(O)=C(O)C=C1
|
|
| MolPort-039-338-957 |
0.64 |
COC1=CC(=CC(O)=C1O)C(=O)O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC(O)=C(O)C(O)=C1
|
|
| MolPort-005-711-894 |
0.64 |
O=C(OCC1=CC=C2OCOC2=C1)C1CC2=CC=CC=C2C(=O)O1
|
|
| MolPort-046-426-888 |
0.64 |
CCCCCCCCCCCCOC(=O)C1=CC(OC(=O)C2=C(CCCCCCCCCC)C(O)=C(O)C(O)=C2CCCCCCCCCC)=C(O)C(O)=C1
|
|
| MolPort-001-739-416 |
0.63 |
COC1=CC(O)=CC2=C1C(=O)OC(C)C2
|
|
| MolPort-028-610-117 |
0.63 |
COC1=C(Cl)C2=C(C(O)=C1)C(=O)OC(C)C2
|
|
| MolPort-039-338-275 |
0.63 |
COC1=C(O)C=CC(C[C@@]2(O)CO[C@@H]([C@H]2COC(C)=O)C2=CC(OC)=C(O)C=C2)=C1
|
|
| MolPort-044-727-676 |
0.63 |
COC1=C2C(=O)O[C@H](CCCCC[C@@H]3CCC[C@]4(CC[C@@H](C)O4)O3)C2=CC(O)=C1
|
|
| MolPort-035-706-043 |
0.63 |
COC1=CC(=CC=C1O)C(O)[C@H]1CO[C@H]([C@H](CO1)[C@@H]1CO[C@@H](CO[C@@H]1C1=CC(OC)=C(O)C(OC)=C1)C(O)C1=CC=C(O)C(OC)=C1)C1=CC(OC)=C(O)C(OC)=C1
|
|
| MolPort-005-944-269 |
0.63 |
COC1=CC2=C(C(=O)OC(C)C2)C(O)=C1Cl
|
|
| MolPort-005-945-866 |
0.63 |
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C(=CC=C1O)C(=O)[C@H](O)CC1=CC(O)=C(O)C=C1
|
|
| MolPort-002-941-952 |
0.63 |
C[C@H]1CCC[C@@H](O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-001-017-587 |
0.63 |
C[C@H]1CCC[C@H](O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MCULE-6695355296 |
0.63 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(OC)C=CC=1O
|
|
| MCULE-5771021964 |
0.63 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=CC=C1O
|
|
| MCULE-5912076797 |
0.63 |
C1(=CC(=C2C(CC(C)OC2=O)=C1)OC)O
|
|
| MCULE-9698179378 |
0.63 |
C1(=CC(=C2C(=C1Cl)CC(C)OC2=O)O)OC
|
|
| MCULE-4368437605 |
0.63 |
[C@@]1(O)(CC2C=CC(O)=C(OC)C=2)CO[C@H](C2C=CC(O)=C(OC)C=2)[C@H]1COC(=O)C
|
|
| MCULE-1240243109 |
0.63 |
O=C1C2C(=CC(=CC=2[C@@H](CCCCC[C@H]2O[C@]3(O[C@H](C)CC3)CCC2)O1)O)OC
|
|
| MCULE-1293573774 |
0.63 |
[C@@H]1(C2C=C(OC)C(O)=C(OC)C=2)[C@]([H])([C@]2([H])[C@H](C3C=C(OC)C(O)=C(OC)C=3)OC[C@]([H])(C(O)C3C=C(OC)C(O)=CC=3)OC2)CO[C@]([H])(C(O)C2C=C(OC)C(O)=CC=2)CO1
|
|
| MCULE-5173720503 |
0.63 |
C1(=C(Cl)C(=C2C(=C1)CC(C)OC2=O)O)OC
|
|
| MCULE-6030683551 |
0.63 |
C1(=C(O)C=CC(C(=O)[C@H](O)CC2=CC=C(O)C(O)=C2)=C1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
|
|
| MCULE-8165772912 |
0.63 |
CC1OC(=O)C2=C(C=C(C=C2O)O)CCCCCC(O)CCC1
|
|
| MCULE-3886817675 |
0.63 |
C1(=O)O[C@@H](C)CCC[C@H](CCCCCC2C=C(C=C(O)C1=2)O)O
|
|
| MCULE-1369283050 |
0.63 |
C1(=O)O[C@@H](C)CCC[C@@H](CCCCCC2C=C(C=C(O)C1=2)O)O
|
|
| MCULE-5698168647 |
0.63 |
O=C1C2C(=CC(=CC=2O)O)CCCCC[C@@H](O)CCC[C@H](C)O1
|
|
| MCULE-6099704440 |
0.63 |
C12=C(OC)C(OC)=CC=C1C(OC2=O)CC(=O)C1CC1
|
|
| MCULE-2426379957 |
0.63 |
C12=C(O)C(=C(O)C(O)=C1C(=O)C1C=C(O)C(C(=O)O)=C(C)C=1C2=O)[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O
|
|
| MCULE-5952628496 |
0.63 |
O1[C@@H](CO)[C@@H]([C@H]([C@H]([C@@H]1C1C(=C(C2C(C3=CC(=C(C(=O)O)C(C)=C3C(C=2C=1O)=O)O)=O)O)O)O)O)O
|
|
| MCULE-9660991205 |
0.63 |
C1(=C(O)C2C(=O)C3C(C)=C(C(O)=O)C(=CC=3C(=O)C=2C(O)=C1O)O)[C@@H]1[C@H](O)[C@@H](O)[C@@H]([C@@H](CO)O1)O
|
|
| MCULE-7552351427 |
0.63 |
CC1C2C(C3C(C(=O)C=2C=C(O)C=1C(=O)O)=C(O)C(O)=C([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C=3O)=O
|
|
| MCULE-5237136036 |
0.63 |
C1(=C(O)C2C(=O)C3C(C)=C(C(O)=O)C(=CC=3C(=O)C=2C(O)=C1O)O)C1C(O)C(O)C(C(CO)O1)O
|
|
| MCULE-4569172898 |
0.63 |
C1(=C(C2COC(CCCCCCC)CC=2C=C1O)O)C(O)=O
|
|
| MCULE-9970757448 |
0.63 |
C12=CC(OC)=C(C=C1COC(=O)C12CCCC1)OC
|
|
| MCULE-5308689680 |
0.63 |
C1(C=C2C(=CC=1OC)C(C1C=C(OC)C(OC)=C(OC)C=1)OC1CCCCC21)OC
|
|
| MCULE-1789061346 |
0.63 |
C1(=O)OC(C2CC2)C2=C1C=C1OCCOC1=C2
|
|
| MCULE-5547668002 |
0.63 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=CC=CC=1OC
|
|
| MCULE-7371805225 |
0.63 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(OC)C=CC=1OC
|
|
| MCULE-4046425285 |
0.63 |
C1(C=C2C(=CC=1OC)C(C1C(OC)=CC=C(OC)C=1)OC1CCCCC21)OC
|
|
| MCULE-1247054670 |
0.63 |
C1(C2=CC=CC(OC)=C2OC)OC2CCCCC2C2=CC(OC)=C(OC)C=C12
|
|
| MolPort-002-508-424 |
0.63 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1CC1)OC2=O
|
|
| MolPort-006-823-907 |
0.63 |
CC1=C(C(O)=O)C(O)=CC2=C1C(=O)C1=C(O)C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(O)C(O)=C1C2=O
|
|
| MolPort-046-697-421 |
0.63 |
CCCCCCCC1CC2=CC(O)=C(C(O)=O)C(O)=C2CO1
|
|
| MolPort-044-181-096 |
0.63 |
CC1=C2C(=O)C3=C(C(O)=C(O)C([C@H]4OC(CO)[C@@H](O)C(O)C4O)=C3O)C(=O)C2=CC(O)=C1C(O)=O
|
|
| MolPort-044-175-470 |
0.63 |
CC1=C(C(O)=O)C(O)=CC2=C1C(=O)C1=C(C(O)=C(O)C([C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)=C1O)C2=O
|
|
| MolPort-000-721-951 |
0.63 |
COC1=CC2=C(C=C1OC)C1(CCCC1)C(=O)OC2
|
|
| MolPort-004-955-565 |
0.63 |
COC1=CC(=CC(OC)=C1OC)C1OC2CCCCC2C2=CC(OC)=C(OC)C=C12
|
|
| MolPort-039-140-508 |
0.63 |
[Al+3].CC1=C2C(=O)C3=C(C([O-])=C(O)C([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C3O)C(=O)C2=CC([O-])=C1C([O-])=O
|
|
| MolPort-000-480-091 |
0.63 |
COC1=CC(C(=O)CC2OC(=O)C3=C2C=CC(OC)=C3OC)=C(OC)C=C1
|
|
| MolPort-006-250-025 |
0.63 |
O=C1OC(C2CC2)C2=C1C=C1OCCOC1=C2
|
|
| MolPort-002-744-770 |
0.63 |
COC1=CC=CC(C2OC3CCCCC3C3=C2C=C(OC)C(OC)=C3)=C1OC
|
|
| MolPort-002-025-225 |
0.63 |
COC1=CC(C2OC3CCCCC3C3=C2C=C(OC)C(OC)=C3)=C(OC)C=C1
|
|
| MolPort-002-742-693 |
0.63 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=C(OC)C=CC=C1)OC2=O
|
|
| MolPort-003-940-604 |
0.62 |
OC1=CC2=C(C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@@H](O2)C2=CC(O)=C(O)C=C2)C(O)=C1
|
|
| MolPort-003-941-527 |
0.62 |
OC1=CC2=C(C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@@H](O2)C2=CC(O)=C(O)C(O)=C2)C(O)=C1
|
|
| MolPort-001-741-358 |
0.62 |
OC1=CC2=C(C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](O2)C2=CC(O)=C(O)C(O)=C2)C(O)=C1
|
|
| MolPort-042-675-352 |
0.62 |
OC1=CC2=C(C[C@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](O2)C2=CC(O)=C(O)C(O)=C2)C(O)=C1
|
|
| MolPort-009-198-789 |
0.62 |
OC1=CC(O)=C2CC(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(OC2=C1)C1=CC(O)=C(O)C=C1
|
|
| MolPort-035-784-136 |
0.62 |
O.OC1=CC2=C(C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](O2)C2=CC(O)=C(O)C(O)=C2)C(O)=C1
|
|
| MolPort-009-758-814 |
0.62 |
OC1=CC2=C(CC(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O2)C2=CC(O)=C(O)C(O)=C2)C(O)=C1
|
|
| MolPort-001-740-964 |
0.62 |
OC1=CC2=C(C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](O2)C2=CC(O)=C(O)C=C2)C(O)=C1
|
|
| MolPort-021-804-747 |
0.62 |
CC1CCCCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-046-426-300 |
0.62 |
CCC[C@H](CCCCCCCC1=C(C(=O)O[C@H](CCC)CCCCCCCC2=CC(O)=CC(O)=C2)C(O)=CC(O)=C1)OC(C)=O
|
|
| MolPort-046-158-446 |
0.62 |
C[C@H]1CCCCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-039-339-122 |
0.62 |
[Al+3].[Ca++].CC1=C(C([O-])=O)C([O-])=CC2=C1C(=O)C1=C(C([O-])=C([O-])C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C1[O-])C2=O
|
|
| MolPort-000-754-368 |
0.62 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=C(O)C(I)=C(O)C(I)=C1)OC2=O
|
|
| MolPort-019-936-760 |
0.62 |
COC1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)C2=C1C(OC)=C(C(C)C)C(O)=C2O
|
|
| MolPort-002-531-172 |
0.62 |
COC1=C2C(CCCCCC(=O)CCC[C@H](C)OC2=O)=CC(O)=C1
|
|
| MolPort-002-520-272 |
0.62 |
COC1=C(OC)C2=C(C=C1)C(OC2=O)C1CC(CC(C)C1=O)C(C)(C)C(C)C
|
|
| MolPort-002-622-739 |
0.62 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C13CC4CC(CC(C4)C1)C3)OC2=O
|
|
| MolPort-001-593-341 |
0.62 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC(O)=CC(O)=C1)OC2=O
|
|
| MolPort-000-207-609 |
0.62 |
CCC(=O)CC1OC(=O)C2=C1C=CC(OC)=C2OC
|
|
| MolPort-028-610-005 |
0.62 |
CC(C)C1=C(O)C(O)=C2C(=C1)[C@H]1OC(=O)[C@@]22CCCC(C)(C)C2[C@H]1O
|
|
| MolPort-002-522-049 |
0.62 |
C[C@H]1CCCC(=O)CCCCCC2=CC(OCC3=CC=CC=C3)=CC(O)=C2C(=O)O1
|
|
| MolPort-046-697-423 |
0.62 |
CC1C2CCC(C)\C=C(C)\CC(C)CC(C)C3(O)OC4=C(C3=O)C(C(O2)C(C)C1O)=C(O)C(O)=C4C
|
|
| MCULE-5312306654 |
0.62 |
C1(=O)O[C@@H](C)CCCC(CCCCCC2C=C(C=C(OC)C1=2)OC)=O
|
|
| MCULE-9046067244 |
0.62 |
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-9752626908 |
0.62 |
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-9913176697 |
0.62 |
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-8110076741 |
0.62 |
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-7760530136 |
0.62 |
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-1925476027 |
0.62 |
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-9356975267 |
0.62 |
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-2467245336 |
0.62 |
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-4110327431 |
0.62 |
[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-3341525983 |
0.62 |
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-3978866251 |
0.62 |
[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-8215821193 |
0.62 |
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-4986853847 |
0.62 |
C1(=O)C2=CC=CC=C2CCC1OC(=O)C1C=CC(=C(OC)C=1)OC
|
|
| MCULE-3974577178 |
0.62 |
C1C(O)=C2C(=O)OC(C)CCCCCCCC2=CC=1O
|
|
| MCULE-4924847499 |
0.62 |
C1C[C@]23C(=O)O[C@H](C(OC)C4C(OC)=C(C(C)C)C(O)=C(O)C=42)[C@@]3([H])C(C)(C)C1
|
|
| MCULE-5029578569 |
0.62 |
[Al+3].[Ca+2].C12C([O-])=C([O-])C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C([O-])C=1C(=O)C1C(C)=C(C(=O)[O-])C([O-])=CC=1C2=O
|
|
| MCULE-7697218527 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(I)C(=C(I)C=1O)O
|
|
| MCULE-8948913948 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)C1CC(CC(C)C1=O)C(C)(C)C(C)C
|
|
| MCULE-6368989291 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(OCC)C=CC=1O
|
|
| MCULE-6489338511 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C12CC3CC(CC(C3)C1)C2
|
|
| MCULE-1354947419 |
0.62 |
C1(=O)O[C@@H](C)CCCC(CCCCCC2=CC(=CC(OC)=C12)O)=O
|
|
| MCULE-3748108109 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(CC)=O
|
|
| MCULE-1919200968 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(O)C=C(O)C=1
|
|
| MCULE-5433612597 |
0.62 |
C1(=CC(=C2C(=C1)C(=O)C1C(=CC=C(C=1C2=O)O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O)C(O)=O
|
|
| MCULE-4368679537 |
0.62 |
C12C3C(C)C(O)C(C)C(CCC(C)C=C(C)CC(C)CC(C4(O)C(=O)C1=C(O4)C(C)=C(O)C=2O)C)O3
|
|
| MCULE-2506388700 |
0.62 |
C1(=O)O[C@@H](C)CCCC(CCCCCC2=CC(=CC(O)=C12)OCC1C=CC=CC=1)=O
|
|
| MCULE-2919707376 |
0.62 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=C(OC)C(=C(OC)C=1)OC
|
|
| MCULE-1276474815 |
0.62 |
C12=CC(OC)=C(C=C1C1CCCCC1OC2C1C=CC=C2C=CC=CC=12)OC
|
|
| MCULE-4654433556 |
0.62 |
[Ca+2].C12C([O-])=CC=C([C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C=1C(=O)C1C=C(C(=O)[O-])C=C(O)C=1C2=O
|
|
| MCULE-7151887391 |
0.62 |
C12(C(=O)C3C=CC=CC=3C1)OC2C1=CC=C(OC)C(OC)=C1
|
|
| MolPort-002-536-462 |
0.62 |
COC1=CC(=CC(OC)=C1OC)C(=O)CC1OC(=O)C2=C1C=CC(OC)=C2OC
|
|
| MolPort-002-744-680 |
0.62 |
COC1=CC2=C(C=C1OC)C(OC1CCCCC21)C1=CC=CC2=CC=CC=C12
|
|
| MolPort-039-052-479 |
0.62 |
CC(C)C1=CC2=C(C(O)=C1O)C13CCCC(C)(C)[C@@H]1[C@@H](O)[C@@H]2O[C@H]3O
|
|
| MolPort-039-052-279 |
0.62 |
[Ca++].OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=CC=C([O-])C2=C1C(=O)C1=C(C(O)=CC(=C1)C([O-])=O)C2=O
|
|
| MolPort-002-164-533 |
0.61 |
COC1=CC=C(C=C1)C(=O)CC1OC(=O)C2=C1C=CC(OC)=C2OC
|
|
| MolPort-000-856-511 |
0.61 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC=C(O)C=C1)OC2=O
|
|
| MolPort-000-487-328 |
0.61 |
COC1=C(OC)C=C(C=C1)C(=O)CC1OC(=O)C2=C1C=CC(OC)=C2OC
|
|
| MolPort-000-207-923 |
0.61 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC(O)=C(O)C=C1)OC2=O
|
|
| MolPort-044-754-079 |
0.61 |
COC1=CC2=C(C(OC)=C1OC)C1=C(C[C@H](C)[C@](C)(O)[C@H]2OC(=O)C2=CC=CC=C2)C=C(O)C(OC)=C1OC
|
|
| MolPort-001-741-608 |
0.61 |
COC1=CC=C(C=C1OC)C1OCC2C(OCC12O)C1=CC(OC)=C(OC)C=C1
|
|
| MolPort-001-740-562 |
0.61 |
CC(O)CCCCCCCCCC(CC1=C(C(O)=O)C(O)=CC(O)=C1)OC(C)=O
|
|
| MolPort-001-741-176 |
0.61 |
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C(C(=O)CCC2=CC=C(O)C=C2)=C(O)C([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C1O
|
|
| MolPort-019-937-432 |
0.61 |
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C(C(=O)CCC2=CC=CC=C2)=C(O)C([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C1O
|
|
| MCULE-9766537455 |
0.61 |
C1(O)C=C(O)C(C(=O)CCC2C=CC(O)=CC=2)=C(O)C=1[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
|
|
| MCULE-1274466728 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=C(C=C1)OC
|
|
| MCULE-1659288775 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=C(OC)C(OC)=C1
|
|
| MCULE-5355100888 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=C(O)C(OC)=C1
|
|
| MCULE-6991294256 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=CC(=CC=1)O
|
|
| MCULE-5266269941 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=C(C(O)=C1)O
|
|
| MCULE-3443138155 |
0.61 |
C1(O)C=C2C(=C(O)C=1)C(=O)O[C@H](C)C2
|
|
| MCULE-4449696638 |
0.61 |
OC1C=C2C[C@H](C)[C@](C)(O)[C@@H](OC(=O)C3C=CC=CC=3)C3C(=C(C(=C(C=3)OC)OC)OC)C2=C(OC)C=1OC
|
|
| MCULE-1258311342 |
0.61 |
C12=CC(O)=C(OC)C(OC)=C1C1=C(OC)C(OC)=C(OC)C=C1[C@H](OC(=O)C1=CC=CC=C1)[C@@](C)(O)[C@@H](C)C2
|
|
| MCULE-1049489089 |
0.61 |
C1=C(CC(CCCCCCCCCC(O)C)OC(C)=O)C(C(O)=O)=C(C=C1O)O
|
|
| MCULE-2548152663 |
0.61 |
C1(OCC2C1(O)COC2C1C=CC(OC)=C(OC)C=1)C1=CC(=C(C=C1)OC)OC
|
|
| MCULE-3452512593 |
0.61 |
C1(O)C(C(=O)CCC2C=CC=CC=2)=C(O)C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(O)C=1[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
|
|
| MCULE-3018147013 |
0.61 |
O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1C1C(O)=C(C(O)=C(C(=O)CCC2C=CC(O)=CC=2)C=1O)[C@H]1[C@@H]([C@H]([C@H](O)[C@H](O1)CO)O)O
|
|
| MCULE-6054290141 |
0.61 |
[C@@]1(O)(CC2C=CC(O)=C(OC)C=2)CO[C@H](C2C=CC(O)=C(OC)C=2)[C@@]1(O)CO
|
|
| MCULE-1374586850 |
0.61 |
C1(=O)C2=CC=CC=C2CC(C(C)(O)CC(OCC)=O)O1
|
|
| MCULE-1321042245 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=CC(O)=C1
|
|
| MCULE-1988281693 |
0.61 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC=CC(OC)=C1
|
|
| MCULE-9773915498 |
0.61 |
C12=C(OC)C(OC)=CC=C1C(OC2=O)CC(C1C=CC=CC=1)=O
|
|
| MCULE-1738451204 |
0.61 |
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
|
|
| MCULE-7967277325 |
0.61 |
C([C@@H]1C(O[C@]2([H])[C@H](O[C@@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)[C@]([H])(OC(=O)C3=CC(O)=C(O)C4OC(=O)[C@H](O)[C@]1([H])C3=4)[C@]2(OC(C1C=C(O)C(O)=C(O)C=1)=O)[H])COC(C1C=C(O)C(O)=C(O)C=1)=O)=O)C(=O)O
|
|
| MCULE-5940899433 |
0.61 |
[C@H]1(CO)O[C@@H](OC(=O)C2C=C(O)C(O)=C(O)C=2)[C@@H]2OC(=O)C3C=C(O)C(O)=C4OC(=O)[C@@H](O)C(C(CC(O)=O)C(=O)O[C@H]1[C@@H]2O)C=34
|
|
| MCULE-1723922621 |
0.61 |
C1(C2C(OC(=O)C3C=C(O)C(O)=C(O)C=3)C(OC(=O)C3C4C(C(C(=O)O2)CC(O)=O)[C@H](O)C(=O)OC=4C(O)=C(O)C=3)C(OC(=O)C2C=C(O)C(O)=C(O)C=2)O1)COC(=O)C1C=C(O)C(O)=C(O)C=1
|
|
| MCULE-7064025344 |
0.61 |
O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1C1C(O)=CC(O)=C(C(C2C=CC(O)=CC=2)=O)C=1O)CO
|
|
| MCULE-7146099364 |
0.61 |
C1C=C2C[C@@H](C3C=CC(OC(=O)C)=CC=3)OC(=O)C2=C(O[C@H]2[C@H](OC(=O)C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(=O)C)O2)C=1
|
|
| MCULE-8147364501 |
0.61 |
C1C=C2C[C@H](C3C=CC(OC(=O)C)=CC=3)OC(=O)C2=C(O[C@H]2[C@H](OC(=O)C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(=O)C)O2)C=1
|
|
| MCULE-7202697653 |
0.61 |
ClC1=C2C(OCCO2)=CC(COC(C2OC(=O)C3=C(C=CC=C3)C2)=O)=C1
|
|
| MolPort-035-706-028 |
0.61 |
COC1=CC(C[C@@]2(O)CO[C@H](C3=CC(OC)=C(O)C=C3)[C@@]2(O)CO)=CC=C1O
|
|
| MolPort-002-164-780 |
0.61 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC=CC=C1)OC2=O
|
|
| MolPort-001-593-320 |
0.61 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC(O)=CC=C1)OC2=O
|
|
| MolPort-046-418-681 |
0.61 |
O[C@@H]1[C@H]2[C@H](CC(O)=O)C(=O)O[C@@H]3[C@@H](COC(=O)C4=CC(O)=C(O)C(O)=C4)O[C@@H](OC(=O)C4=CC(O)=C(O)C(O)=C4)[C@H](OC(=O)C4=C2C(OC1=O)=C(O)C(O)=C4)[C@H]3OC(=O)C1=CC(O)=C(O)C(O)=C1
|
|
| MolPort-039-338-787 |
0.61 |
OC[C@H]1O[C@@H](OC(=O)C2=CC(O)=C(O)C(O)=C2)[C@@H]2OC(=O)C3=C4C([C@H](O)C(=O)OC4=C(O)C(O)=C3)C(CC(O)=O)C(=O)O[C@H]1[C@@H]2O
|
|
| MolPort-039-338-785 |
0.61 |
O[C@H]1C2C(CC(O)=O)C(=O)OC3C(COC(=O)C4=CC(O)=C(O)C(O)=C4)OC(OC(=O)C4=CC(O)=C(O)C(O)=C4)C(OC(=O)C4=CC(O)=C(O)C(OC1=O)=C24)C3OC(=O)C1=CC(O)=C(O)C(O)=C1
|
|
| MolPort-044-194-953 |
0.61 |
Cl.COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@H](O)C[C@H](O[C@@H]4CO[C@@H](C)[C@@H](O)[C@H]4N)C3=C1O)C2=O
|
|
| MolPort-035-705-789 |
0.61 |
CC(=O)OC[C@H]1O[C@@H](OC2=C3C(=O)O[C@@H](CC3=CC=C2)C2=CC=C(OC(C)=O)C=C2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
|
|
| MolPort-035-705-788 |
0.61 |
CC(=O)OC[C@H]1O[C@@H](OC2=C3C(=O)O[C@H](CC3=CC=C2)C2=CC=C(OC(C)=O)C=C2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
|
|
| MolPort-001-741-529 |
0.61 |
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C(C(=O)C2=CC=C(O)C=C2)=C(O)C=C1O
|
|
| MolPort-009-227-400 |
0.61 |
ClC1=CC(COC(=O)C2CC3=CC=CC=C3C(=O)O2)=CC2=C1OCCO2
|
|
| MolPort-002-164-342 |
0.60 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=C(O)C=CC(Cl)=C1)OC2=O
|
|
| MolPort-001-739-391 |
0.60 |
COC1=C2C(=O)OCC2=C(C)C2=C1CC1C(C)(CC(O)C3(O)C1(C)CCC(=O)OC3(C)C)O2
|
|
| MolPort-001-830-822 |
0.60 |
CCC1=CC=C(C=C1)C(=O)CC1OC(=O)C2=C1C=CC(OC)=C2OC
|
|
| MolPort-005-944-641 |
0.60 |
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C(=CC=C1O)C(=O)C(O)CC1=CC=C(O)C=C1
|
|
| MolPort-046-508-979 |
0.60 |
OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C[C@H]1OC(=O)C1=CC(O)=C(O)C(O)=C1
|
|
| MolPort-002-345-860 |
0.60 |
COC1=C(OC)C2=C(C=C1)C(CC(=O)C1=CC=C(C)C=C1)OC2=O
|
|
| MolPort-027-853-687 |
0.60 |
OC1=CC=C(C=C1)C1CC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-039-338-881 |
0.60 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3
|
|
| MolPort-001-017-583 |
0.60 |
C[C@H]1CCCC(=O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-046-764-902 |
0.60 |
[2H]C([2H])([2H])C1([2H])OC(=O)C2=C(O)C=C(O)C=C2CCCCCC(=O)CCC1([2H])[2H]
|
|
| MolPort-003-248-260 |
0.60 |
CC1CCCC(=O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-039-052-534 |
0.60 |
COC1=C(O)C=CC(C[C@@]2(O)CO[C@@H]([C@H]2CO)C2=CC(OC)=C(O)C=C2)=C1
|
|
| MCULE-5350642451 |
0.60 |
C12C(OC)=CC=C(OC)C=1C1CCCCC1OC2C1=CC=C(C=C1)Br |
|
| MolPort-002-743-515 |
0.60 |
COC1=CC2=C(C=C1OC)C(OC1CCCCC21)C1=CC(OC)=C(OCC2=CC=CC=C2)C=C1
|
|
| MolPort-035-705-787 |
0.60 |
OC[C@H]1O[C@@H](OC2=C3C(=O)OC(CC3=CC=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
|
|
| MolPort-000-475-817 |
0.60 |
COC1=C(OC(=O)C2CC3=C(C=CC=C3)C(=O)O2)C=CC(C=O)=C1
|
|
| MolPort-000-475-815 |
0.60 |
COC1=C(OC(=O)C2(C)CC3=C(C=CC=C3)C(=O)O2)C=CC(C=O)=C1
|
|
| MolPort-035-706-079 |
0.60 |
COC1=CC(=CC(OC)=C1O)[C@H]1OC[C@@H]2[C@H](OC[C@]12O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C1=CC(OC)=C(O)C=C1
|
|
| MolPort-046-790-464 |
0.60 |
CCO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)C2=C1C=C(C(C)C)C(O)=C2O
|
|
| MCULE-9159021987 |
0.60 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1=CC(Cl)=CC=C1O
|
|
| MCULE-2700344529 |
0.60 |
C12CC3C(OC1=C(C1COC(=O)C=1C=2OC)C)(C)CC(O)C1(O)C(C)(C)OC(=O)CCC31C
|
|
| MCULE-9708040260 |
0.60 |
[C@@H]1(CO)[C@@H](O)[C@@H]([C@H]([C@@H](O1)C1=C(C=CC(C(=O)C(O)CC2C=CC(O)=CC=2)=C1O)O)O)O
|
|
| MCULE-3021266232 |
0.60 |
C12=C(OC)C(OC)=CC=C1C(OC2=O)CC(=O)C1C=CC(=CC=1)C
|
|
| MCULE-6150223640 |
0.60 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=CC(=CC=1)CC
|
|
| MCULE-4382912006 |
0.60 |
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
|
|
| MCULE-1154941681 |
0.60 |
C1(O)C=C2CC(C3C=CC(O)=CC=3)OC(=O)C2=C(O)C=1
|
|
| MCULE-4870413505 |
0.60 |
[C@@]1(O)(CC2C=CC(O)=C(OC)C=2)CO[C@H](C2C=CC(O)=C(OC)C=2)[C@H]1CO
|
|
| MCULE-5743024129 |
0.60 |
CC1OC(=O)C2=C(C=C(C=C2O)O)CCCCCC(=O)CCC1
|
|
| MCULE-1900750226 |
0.60 |
C12CCCCCC(CCC[C@H](C)OC(=O)C=1C(O)=CC(O)=C2)=O
|
|
| MCULE-4858628558 |
0.60 |
C1(=C(C=C2C(C3CCCCC3OC2C2C=CC(OCC3C=CC=CC=3)=C(OC)C=2)=C1)OC)OC
|
|
| MCULE-5449434971 |
0.60 |
C1(=O)C2=CC=CC=C2CC(O1)C(=O)OC1C=CC(=CC=1OC)C=O
|
|
| MCULE-7649590669 |
0.60 |
C1(C)(CC2=CC=CC=C2C(=O)O1)C(=O)OC1C=CC(=CC=1OC)C=O
|
|
| MCULE-8129562144 |
0.60 |
C1C=C2CC(C3C=CC(O)=CC=3)OC(=O)C2=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=1
|
|
| MCULE-1120796668 |
0.60 |
C1(OC)C=C([C@@H]2[C@@]3([H])CO[C@H](C4C=C(OC)C(O)=C(OC)C=4)[C@@]3(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)CO2)C=CC=1O
|
|
| MCULE-7271489978 |
0.60 |
C12C(O)[C@@]3([C@@]4(C)CCC(OC(C)(C)[C@]4(O)[C@H](O)C[C@@]3(OC1=C(C1COC(=O)C=1C=2OC)C)C)=O)[H]
|
|
| MCULE-2391123504 |
0.60 |
C1(OC)C=C([C@@H]2[C@@]3([H])CO[C@H](C4C=C(OC)C(O)=CC=4)[C@@]3(O)CO2)C=CC=1O
|
|
| MCULE-4778304263 |
0.60 |
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
|
|
| MCULE-6029890850 |
0.60 |
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
|
|
| MCULE-2294043556 |
0.60 |
C1(C2C=CC=CC=2C(=O)O1)C(OC(=O)C1=CC=C(C=C1)N(=O)=O)C1C=CC=C(OC)C=1OC
|
|
| MCULE-4788656563 |
0.60 |
C12C(OC)=C(OC)C=CC=1C(OC2=O)CC(=O)C1C=CC(=C(I)C=1)O
|
|
