| MCULE-1218384038 |
1 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@H]1O |
|
| MCULE-7925068743 |
1 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@@H]1O |
|
| MCULE-1974040943 |
1 |
C12=CC[C@]3([C@@](C)(CC[C@]4([H])[C@]3(C)C[C@@H](O)[C@@H]([C@@]4(C)CO)O)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H] |
|
| MCULE-9693195749 |
1 |
[C@@H]1(O)C[C@@]2(C3CC=C4C5CC(C)(C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@]([C@@H]1O)(C)CO)C |
|
| MCULE-1389326170 |
1 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@@H]1O |
|
| MCULE-5686534690 |
1 |
C12=CCC3C(C)(CCC4C3(C)CC(O)C(C4(C)CO)O)C1(C)CCC1(CCC(C)C(C)C21)C(O)=O |
|
| MCULE-4431659207 |
1 |
C1(O)CC2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(CO)(C)C1O |
|
| MCULE-5436553655 |
1 |
[C@@H]1(O)C[C@@]2([C@@]3([H])CC=C4[C@]5([C@](C(O)=O)(CCC(C)(C)C5)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@](C)(CO)[C@H]1O)[H])C |
|
| MCULE-6147550234 |
1 |
[C@@H]1(C[C@@]2([C@@]3([H])CC=C4[C@@]5([H])[C@](CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@]([C@H]1O)(C)CO)(C(O)=O)CCC(C)(C)C5)C)O |
|
| MCULE-5774214368 |
1 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MolPort-005-945-034 |
0.98 |
COc1cc(cc(OC)c1OC)-c1oc2c(OC)c(OC)cc(OC)c2c(=O)c1OC |
|
| MolPort-001-740-776 |
0.98 |
COc1cc(ccc1O)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1OC |
|
| MolPort-009-015-209 |
0.98 |
COc1cc(cc(OC)c1OC)-c1oc2c(OC)c(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-005-945-033 |
0.98 |
COc1ccc(cc1OC)-c1oc2c(OC)c(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MCULE-6588005387 |
0.98 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([C@]([C@@H](C[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)([C@H]1O)CO)O)(C(=O)O)CCC(C)(C)C5)[H] |
|
| MCULE-7688714216 |
0.98 |
O=C(O)[C@@]12[C@H](O)C[C@]3(C)C(=CC[C@]4([C@@]3(C)CC[C@]3([H])[C@@]4(C[C@@H]([C@@H](C3(CO)CO)O)O)C)[H])[C@]1([H])CC(C)(C)CC2 |
|
| MCULE-3600048668 |
0.98 |
[C@@]12(C)C[C@@H](O)[C@@]3([C@@]([H])(CC(CC3)(C)C)C1=CC[C@@]1([H])[C@@]2(C)CC[C@@]2([C@]1(C)C[C@@H]([C@H](O)[C@@]2(C)CO)O)[H])C(O)=O |
|
| MolPort-046-509-041 |
0.97 |
COc1ccc(cc1OC)-c1oc2c(O)c(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-046-509-041 |
0.97 |
COc1ccc(cc1OC)-c1oc2c(O)c(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-023-298-919 |
0.96 |
COc1cc(OC)c2c(oc(-c3cc(OC)c(OC)c(OC)c3)c(OC)c2=O)c1O |
|
| MolPort-003-804-008 |
0.96 |
COc1cc(cc(OC)c1OC)-c1oc2cc(O)cc(O)c2c(=O)c1OC |
|
| MolPort-023-298-919 |
0.96 |
COc1cc(OC)c2c(oc(-c3cc(OC)c(OC)c(OC)c3)c(OC)c2=O)c1O |
|
| MolPort-001-742-367 |
0.95 |
COc1cc(ccc1O)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-001-742-702 |
0.95 |
COc1ccc(cc1OC)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-005-944-718 |
0.95 |
COc1cc(ccc1O)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-023-298-916 |
0.95 |
COc1cc(cc(OC)c1OC)-c1oc2cc(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-003-665-800 |
0.95 |
COc1ccc(cc1OC)-c1oc2cc(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-046-790-463 |
0.95 |
COc1cc(O)c2c(c1)oc(-c1cc(OC)c(OC)c(OC)c1)c(OC)c2=O |
|
| MolPort-046-790-463 |
0.95 |
COc1cc(O)c2c(c1)oc(-c1cc(OC)c(OC)c(OC)c1)c(OC)c2=O |
|
| MolPort-023-298-916 |
0.95 |
COc1cc(cc(OC)c1OC)-c1oc2cc(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MCULE-3885425015 |
0.95 |
[C@H]1(C[C@@]2([C@@]3([H])CC=C4[C@]5([C@](CC[C@@]4(C)[C@]3(C)C[C@H]([C@@]2([H])[C@](CO)([C@H]1O)C)O)(C(=O)O)CC[C@@H](C)[C@@H]5C)[H])C)O |
|
| MCULE-3614931522 |
0.95 |
CC1([C@@]2([H])[C@]([C@@]3([C@](CC2)(C)[C@]2(C([C@]4([C@](CC2)(C(=O)O)CC[C@@H](C)[C@@H]4C)[H])=CC3)C)[H])(C)C[C@@H](O)[C@@H]1O)C |
|
| MCULE-3800481886 |
0.95 |
C1(C)(C)C[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)CC[C@H](O)[C@](CO)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1 |
|
| MCULE-6409888378 |
0.95 |
C1[C@]2([H])[C@@](C(O)=O)(CC[C@]3(C)C2=CC[C@@]2([H])[C@@]3(C)CC[C@]3([H])[C@]2(C)CC[C@H](O)[C@]3(CO)C)CCC1(C)C |
|
| MCULE-9211922250 |
0.95 |
C12[C@H]3[C@@](CCC(C)(C)C3)(C(O)=O)CC[C@]1(C)[C@@]1(C)CC[C@@H]3[C@@](C)(CC[C@H](O)[C@@]3(C)CO)[C@H]1CC=2 |
|
| MCULE-1780641937 |
0.95 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C([C@@H](O)[C@H](O)C[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H] |
|
| MCULE-1067283755 |
0.95 |
C1(O)CC2(C)C3CC=C4C5CC(C)(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C)(C)C1O |
|
| MCULE-4522488137 |
0.95 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MCULE-2299251979 |
0.95 |
C[C@@]12CC[C@@]3([H])C([C@@H](O)[C@H](O)C[C@]3(C)[C@@]1([H])CC=C1[C@]3([H])CC(C)(C)CC[C@]3(C(=O)O)CC[C@@]21C)(C)C |
|
| MCULE-2675118265 |
0.95 |
C1[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CCC1(C)C |
|
| MCULE-1602610126 |
0.95 |
CC1C(C)C2C(C(O)=O)(CCC3(C)C4(C)CCC5C(C)(C)C(O)C(O)CC5(C)C4CC=C32)CC1 |
|
| MolPort-004-964-332 |
0.94 |
COc1cc(ccc1O)-c1oc2cc(O)cc(O)c2c(=O)c1OC |
|
| MolPort-009-753-034 |
0.94 |
COc1cc(ccc1O)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-001-740-789 |
0.94 |
COc1cc(O)c2c(c1)oc(-c1cc(O)c(OC)c(OC)c1)c(OC)c2=O |
|
| MolPort-005-945-338 |
0.94 |
COc1cc(O)c2c(c1)oc(-c1ccc(OC)c(OC)c1)c(OC)c2=O |
|
| MolPort-002-508-399 |
0.94 |
COc1cc(OC)c2c(c1)oc(-c1ccc(OC)c(OC)c1)c(OC)c2=O |
|
| MolPort-023-274-268 |
0.93 |
COc1ccc(cc1O)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-000-767-868 |
0.93 |
COc1cc2oc(-c3ccc(O)c(O)c3)c(OC)c(=O)c2c(O)c1OC |
|
| MolPort-005-938-589 |
0.93 |
COc1ccc(cc1O)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-019-936-991 |
0.93 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(OC)c1)c(OC)c2=O |
|
| MolPort-019-936-991 |
0.93 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(OC)c1)c(OC)c2=O |
|
| MolPort-023-274-268 |
0.93 |
COc1ccc(cc1O)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-001-740-298 |
0.93 |
COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(OC)c(=O)c2c1O |
|
| MCULE-4023009546 |
0.93 |
C([C@]12CCC(C)(C)C[C@@]1([H])C1=CC[C@]3([H])[C@]4(CC[C@H](O)[C@@](C)(C=O)[C@]4([H])CC[C@@]3(C)[C@]1(C)C[C@H]2O)C)(=O)O |
|
| MCULE-2374686913 |
0.93 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(O)=O)[C@H](O)C[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O |
|
| MCULE-8509022096 |
0.93 |
[C@]12(C)[C@@]([H])(CC[C@@]3(C)[C@@]4(C)C([C@@]5([H])[C@](C(=O)O)(CCC(C)(C)C5)[C@H](O)C4)=CC[C@]13[H])[C@](C)(C=O)[C@@H](O)CC2 |
|
| MolPort-035-705-977 |
0.92 |
COc1ccc(cc1)-c1oc2c(OC)c(O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-035-705-977 |
0.92 |
COc1ccc(cc1)-c1oc2c(OC)c(O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-005-981-178 |
0.92 |
COc1ccc2c(c1)oc(-c1cc(OC)c(OC)c(OC)c1)c(OC)c2=O |
|
| MCULE-8045386580 |
0.92 |
C1(=O)C([C@@]2([H])[C@](C)(CC1)[C@]1([H])[C@@]([C@]3(C(=CC1)[C@]1([C@@](CCC(C1)(C)C)(C(O)=O)CC3)[H])C)(C)CC2)(C)C |
|
| MCULE-5064546197 |
0.92 |
[C@H]1(C)[C@H](C)[C@@]2([H])C3=CC[C@@]4([C@@]5(C)CCC(C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1)=O)[H] |
|
| MCULE-9474095410 |
0.92 |
[C@@H]1(O)C([C@@]2([H])[C@](C)(CC1)[C@]1([H])[C@@]([C@]3(C(=CC1)[C@]1([C@@](CC[C@H]([C@@H]1C)C)(C(O)=O)CC3)[H])C)(C)CC2)(C)C |
|
| MCULE-5111117747 |
0.92 |
C[C@H]1[C@H](C)[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1 |
|
| MCULE-6888052424 |
0.92 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O |
|
| MCULE-7088367969 |
0.92 |
[C@@]12(C)CC[C@@]3([C@@]([H])(CC(CC3)(C)C)C1=CC[C@@]1([H])[C@@]2(C)CC[C@@]2([C@]1(C)CC[C@H](O)C2(C)C)[H])C(O)=O |
|
| MCULE-9335086572 |
0.92 |
CC1C(C)C2C(C(O)=O)(CCC3(C)C4(C)CCC5C(C)(C)C(=O)CCC5(C)C4CC=C32)CC1 |
|
| MCULE-3143886740 |
0.92 |
C12(C)CCC3(C(CC(CC3)(C)C)C1=CCC1C2(C)CCC2C1(C)CCC(O)C2(C)C)C(O)=O |
|
| MCULE-6217200752 |
0.92 |
O=C(O)[C@]12[C@@](C3=CC[C@@]4([C@]5(CCC(=O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC1)C)[H])([H])[C@@H](C)[C@H](C)CC2 |
|
| MCULE-6367656540 |
0.92 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(O)=O)[H] |
|
| MCULE-1308336736 |
0.92 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C(C(O)CC[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)C(C)C21)C(O)=O)[H] |
|
| MolPort-003-665-803 |
0.91 |
COc1ccc(cc1OC)-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-001-741-117 |
0.91 |
COc1ccc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1OC |
|
| MolPort-001-741-083 |
0.91 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-023-279-004 |
0.91 |
COc1ccc(cc1)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1OC |
|
| MolPort-001-740-922 |
0.91 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(O)c1 |
|
| MolPort-039-141-802 |
0.91 |
COc1cc(O)c2c(c1)oc(-c1ccc(OC)c(O)c1)c(OC)c2=O |
|
| MolPort-039-141-802 |
0.91 |
COc1cc(O)c2c(c1)oc(-c1ccc(OC)c(O)c1)c(OC)c2=O |
|
| MolPort-023-279-004 |
0.91 |
COc1ccc(cc1)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1OC |
|
| MCULE-7803183347 |
0.91 |
O[C@@H]1[C@](CO)(C)C2[C@](C3CC=C4[C@]5([H])[C@H](O)C(C)(C)CC[C@]5(C(O)=O)CC[C@]4([C@]3(C)CC2)C)(C)C[C@H]1O |
|
| MCULE-6215568256 |
0.91 |
[C@@H]1(O)C[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@@]([C@H]1O)(CO)C)C |
|
| MCULE-7221302841 |
0.91 |
CC1(C)CC2C(C(O)=O)(CCC3C4(C)CCC5C(C(O)=O)(C)C(O)C(O)CC5(C)C4CCC=32)CC1 |
|
| MCULE-1049317957 |
0.91 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)C(=C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MCULE-9966885116 |
0.91 |
[C@@H]1(O)CC2(C3CC=C4C5C(C)C(=C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(CO)(C)[C@H]1O)C |
|
| MCULE-9416273604 |
0.91 |
CC1(CC[C@@]2(C(=O)O)[C@H](C3=C(CC2)[C@@]2(CC[C@H]4[C@@](C(=O)O)(C)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]2CC3)C)C1)C |
|
| MolPort-001-742-139 |
0.90 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(OC)c2=O |
|
| MCULE-7633761938 |
0.90 |
C(O)(C1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1)=O |
|
| MCULE-7626806338 |
0.90 |
C1CC2(C)C3CC=C4C5C(C)C(C)C(O)CC5(C(=O)O)CCC4(C)C3(C)CCC2C(C)(C)C1O |
|
| MolPort-046-790-537 |
0.89 |
COc1cc(ccc1O)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1O |
|
| MolPort-027-637-295 |
0.89 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)cc(OC)c(OC)c2o1 |
|
| MolPort-046-790-442 |
0.89 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-005-945-080 |
0.89 |
COc1cc(cc2OCOc12)-c1oc2c(OC)c(OC)c(OC)c(OC)c2c(=O)c1OC |
|
| MolPort-021-804-799 |
0.89 |
COc1c(O)c(OC)c2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1 |
|
| MolPort-046-790-537 |
0.89 |
COc1cc(ccc1O)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1O |
|
| MolPort-045-999-002 |
0.89 |
COc1cc(ccc1O)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1O |
|
| MolPort-046-790-442 |
0.89 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-027-637-295 |
0.89 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)cc(OC)c(OC)c2o1 |
|
| MolPort-045-999-002 |
0.89 |
COc1cc(ccc1O)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1O |
|
| MolPort-021-804-799 |
0.89 |
COc1c(O)c(OC)c2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1 |
|
| MCULE-5689703166 |
0.89 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@@H]1O |
|
| MCULE-9482226349 |
0.89 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C([C@@H](O)[C@H](O)C[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@@](C)(O)[C@@]21[H])C(O)=O)[H] |
|
| MCULE-4704690733 |
0.89 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MCULE-8942317491 |
0.89 |
[C@@H]1(O)C[C@@]2([C@@]3([H])CC=C4[C@@]5([H])[C@](CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C([C@H]1O)(C)C)(C(=O)O)CCC(C)(C)[C@H]5O)C |
|
| MCULE-3986896794 |
0.89 |
CC1([C@@H](O)[C@H](O)C[C@@]2(C)[C@H]1CC[C@]1([C@@]3(C)C([C@@H]4[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC3)=CC[C@@H]12)C)C |
|
| MCULE-1404184811 |
0.89 |
C1CC2(C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(CO)(C)C1O)C |
|
| MCULE-3751237146 |
0.89 |
C[C@H]1[C@](O)(C)[C@@H]2[C@@](C(=O)O)(CC[C@]3([C@@]4(C)[C@@H]([C@@]5([C@@H](CC4)[C@@](CO)(C)[C@@H](O)CC5)C)CC=C32)C)CC1 |
|
| MCULE-3124415982 |
0.89 |
C1(O)C(O)C2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(CO)(CO)C1=O |
|
| MolPort-044-727-171 |
0.88 |
COc1c(O)c2c(oc(cc2=O)-c2ccc(O)c(O)c2)c(OC)c1OC |
|
| MolPort-035-705-982 |
0.88 |
COc1cc2oc(-c3ccc(O)cc3)c(OC)c(=O)c2c(O)c1OC |
|
| MolPort-009-019-265 |
0.88 |
COc1cccc(c1)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-006-668-499 |
0.88 |
COc1c(O)cc2oc(-c3ccc(O)cc3)c(OC)c(=O)c2c1O |
|
| MolPort-035-705-982 |
0.88 |
COc1cc2oc(-c3ccc(O)cc3)c(OC)c(=O)c2c(O)c1OC |
|
| MolPort-044-727-171 |
0.88 |
COc1c(O)c2c(oc(cc2=O)-c2ccc(O)c(O)c2)c(OC)c1OC |
|
| MolPort-002-515-732 |
0.88 |
COc1ccc(cc1OC(C)=O)-c1oc2cc(OC)c(OC(C)=O)c(OC)c2c(=O)c1OC |
|
| MolPort-005-944-638 |
0.88 |
COc1c(O)cc(O)c2c1oc(-c1ccccc1)c(OC)c2=O |
|
| MCULE-1939531919 |
0.88 |
CC1CC(C(O)=O)(C2C=CCCC2)C1 |
|
| MCULE-7708235386 |
0.88 |
OC(C1(CC=CC1)CC1CC=CCC1)=O |
|
| MCULE-5624348400 |
0.88 |
C1(C(=O)O)CC2C=CC1CC2 |
|
| MCULE-3959902732 |
0.88 |
OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O |
|
| MCULE-4280394560 |
0.88 |
C1C(=O)[C@]2(C)C3CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2[C@](C)(CO)[C@H]1O |
|
| MolPort-035-705-978 |
0.87 |
COc1ccc(cc1)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-044-754-131 |
0.87 |
COc1cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c(O)c1OC |
|
| MolPort-039-338-723 |
0.87 |
COc1c(O)cc(O)c2c1oc(-c1ccc(O)cc1)c(O)c2=O |
|
| MolPort-001-742-583 |
0.87 |
COc1cc(ccc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-035-705-978 |
0.87 |
COc1ccc(cc1)-c1oc2c(OC)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-044-754-131 |
0.87 |
COc1cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c(O)c1OC |
|
| MolPort-039-338-723 |
0.87 |
COc1c(O)cc(O)c2c1oc(-c1ccc(O)cc1)c(O)c2=O |
|
| MCULE-2655341532 |
0.87 |
C1CC2(C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C1O)(C(O)=O)C)C |
|
| MCULE-3259874247 |
0.87 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MCULE-6478033386 |
0.87 |
[C@@H]1(O)[C@H](O)[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2C([C@H]1O)(C)C)C |
|
| MCULE-9540409196 |
0.87 |
C1C[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@]([C@H]1O)(C(O)=O)C)C |
|
| MolPort-035-705-979 |
0.86 |
COc1ccc(cc1OC)-c1oc2cc(OC)c(OC)c(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-046-158-537 |
0.86 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(OC)c1)c(O)c2=O |
|
| MolPort-021-804-611 |
0.86 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(O)c(OC)c2o1 |
|
| MolPort-035-705-980 |
0.86 |
COc1cc(ccc1OC(C)=O)-c1oc2cc(OC(C)=O)c(OC)c(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-035-705-979 |
0.86 |
COc1ccc(cc1OC)-c1oc2cc(OC)c(OC)c(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-035-705-980 |
0.86 |
COc1cc(ccc1OC(C)=O)-c1oc2cc(OC(C)=O)c(OC)c(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-000-676-444 |
0.86 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC |
|
| MolPort-021-804-611 |
0.86 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(O)c(OC)c2o1 |
|
| MolPort-001-740-951 |
0.86 |
COc1cc(ccc1O)-c1cc(=O)c2c(O)c(OC)c(OC)c(O)c2o1 |
|
| MolPort-046-158-537 |
0.86 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(OC)c1)c(O)c2=O |
|
| MolPort-009-753-052 |
0.86 |
COc1c(O)ccc(O)c1-c1cc(=O)c2c(O)cc(O)c(OC)c2o1 |
|
| MCULE-9700928997 |
0.86 |
C12CCCCC1C(C(O)=O)C(C1CCCCC=21)C(O)=O |
|
| MCULE-5286515274 |
0.86 |
C1C(C(C)(C(=O)O)C(=O)O)C=CCC1 |
|
| MCULE-6672254923 |
0.86 |
C(=O)(O)C(C)(C)C1CC[C@@]2(C(CC=C3[C@]4([H])[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC[C@@]23C)[C@@]1(C)CC(=O)O)C |
|
| MCULE-2496014695 |
0.86 |
C1(C)(C(O)=O)C2CCCCC2=C2C(CCCC2)C1C(O)=O |
|
| MCULE-8297574712 |
0.86 |
C1(C2CCC(C=C2)C1C(O)=O)C(O)=O |
|
| MCULE-1352194754 |
0.86 |
C1CC2(C)C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C)(C)C1O |
|
| MolPort-039-337-171 |
0.85 |
COc1c(O)cc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-001-741-910 |
0.85 |
COc1ccc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-003-665-805 |
0.85 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-001-741-167 |
0.85 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-002-746-631 |
0.85 |
COc1cc(O)ccc1-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-001-740-349 |
0.85 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)cc1 |
|
| MolPort-000-165-389 |
0.85 |
COc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1OC |
|
| MolPort-039-337-171 |
0.85 |
COc1c(O)cc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-001-741-187 |
0.84 |
COc1ccc(cc1)-c1oc2cc(OC)cc(O)c2c(=O)c1OC |
|
| MolPort-001-740-355 |
0.84 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)cc1)c(OC)c2=O |
|
| MolPort-039-338-694 |
0.84 |
COc1cc(OC)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-687-450 |
0.84 |
COc1c(O)cc(O)c2c1oc(-c1ccccc1)c(O)c2=O |
|
| MolPort-003-804-013 |
0.84 |
COc1cccc(c1)-c1oc2cc(OC)ccc2c(=O)c1OC |
|
| MolPort-019-937-105 |
0.84 |
COc1cccc(O)c1-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-001-742-112 |
0.84 |
COc1c(O)c2c(oc(cc2=O)-c2ccc(O)cc2)c(OC)c1OC |
|
| MolPort-004-960-044 |
0.84 |
COc1ccc(cc1OC)-c1cc(=O)c2ccc(OC)c(OC)c2o1 |
|
| MolPort-039-338-131 |
0.84 |
COc1cc(O)c2c(c1)oc(-c1ccc(OC)c(O)c1)c(O)c2=O |
|
| MolPort-000-165-392 |
0.84 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1cc(OC)c(OC)c(OC)c1OC |
|
| MolPort-035-683-146 |
0.84 |
COc1c(oc2cc(OC(C)=O)cc(OC(C)=O)c2c1=O)-c1ccc(OC(C)=O)c(OC(C)=O)c1 |
|
| MolPort-039-338-694 |
0.84 |
COc1cc(OC)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-687-450 |
0.84 |
COc1c(O)cc(O)c2c1oc(-c1ccccc1)c(O)c2=O |
|
| MolPort-019-937-105 |
0.84 |
COc1cccc(O)c1-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1 |
|
| MolPort-039-338-131 |
0.84 |
COc1cc(O)c2c(c1)oc(-c1ccc(OC)c(O)c1)c(O)c2=O |
|
| MolPort-035-683-146 |
0.84 |
COc1c(oc2cc(OC(C)=O)cc(OC(C)=O)c2c1=O)-c1ccc(OC(C)=O)c(OC(C)=O)c1 |
|
| MCULE-4609643145 |
0.84 |
C12C(C)(C)CCCC=1CC(C(O)=O)C(C(O)=O)C2 |
|
| MCULE-4874634113 |
0.84 |
C1(CCCC)(C(O)=O)CC(C)=C(CC1C(O)=O)C |
|
| MCULE-4272187140 |
0.84 |
C1(CC(C)=CC(C)C1C(O)=O)C(O)=O |
|
| MCULE-7638135284 |
0.84 |
C1(O)CC2(C)C3CC=C4C5C(O)(C)C(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(C)(C)C1=O |
|
| MCULE-8052468805 |
0.84 |
C1C(CC)C(C(=O)O)C(C(=O)O)CC=1 |
|
| MCULE-2445591436 |
0.84 |
C1C[C@]2([H])[C@](C(=O)O)(C)[C@H](C[C@@H](CC)O)C(C)=C[C@]2([H])CC1 |
|
| MCULE-9137191737 |
0.84 |
C1(C)(C)C=C(C)CC(C(O)=O)C1C(O)=O |
|
| MCULE-8879177648 |
0.84 |
OC(C1(CC=CCC1)CC1CC=CC1)=O |
|
| MolPort-039-063-527 |
0.83 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)cc(OC)c(OC)c2o1 |
|
| MolPort-006-668-548 |
0.83 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-000-648-125 |
0.83 |
COc1cc(cc(OC)c1OC)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-046-153-791 |
0.83 |
COc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12 |
|
| MolPort-003-665-818 |
0.83 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-761-061 |
0.83 |
COc1ccc(cc1)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1O |
|
| MolPort-002-832-070 |
0.83 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccccc1 |
|
| MolPort-023-279-020 |
0.83 |
COc1c(O)c(OC)c2oc(cc(=O)c2c1O)-c1ccccc1 |
|
| MolPort-002-512-354 |
0.83 |
COc1c(O)c2c(oc(cc2=O)-c2c(O)cccc2O)c(OC)c1OC |
|
| MolPort-039-339-017 |
0.83 |
COc1cc(cc(O)c1OC)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-023-279-020 |
0.83 |
COc1c(O)c(OC)c2oc(cc(=O)c2c1O)-c1ccccc1 |
|
| MolPort-039-063-527 |
0.83 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)cc(OC)c(OC)c2o1 |
|
| MolPort-046-153-791 |
0.83 |
COc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12 |
|
| MolPort-039-339-017 |
0.83 |
COc1cc(cc(O)c1OC)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-046-761-061 |
0.83 |
COc1ccc(cc1)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1O |
|
| MCULE-8629297693 |
0.83 |
C1C[C@@]2(C3CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C)CC[C@]4([C@]3(C)CC[C@@]2([H])[C@](C)([C@@H]1O)C(O)=O)C)C |
|
| MCULE-6601751883 |
0.83 |
C1(C)CC(CCC=1C)C(O)=O |
|
| MCULE-4778256781 |
0.83 |
C(O)(=O)CC[C@]1(C)[C@@]2([H])CC=C3[C@]4([H])[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]3(C)[C@]2(C)CC[C@H]1C(C)=C |
|
| MCULE-6949149768 |
0.83 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](C=O)(C)[C@H]1O |
|
| MCULE-1283574747 |
0.83 |
C[C@@]12CC[C@@]3([H])[C@@]([C@H](O)CC[C@]3(C)[C@@]1([H])CC=C1[C@]3([H])CC(C)(C)CC[C@]3(C)CC[C@@]21C)(C)C(=O)O |
|
| MCULE-5384515579 |
0.83 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1O |
|
| MCULE-1670830332 |
0.83 |
C(C(O)=O)C[C@]1(C)[C@@]2([H])CC=C3[C@]4([H])[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]3(C)[C@]2(C)CC[C@]1(C(C)=C)[H] |
|
| MCULE-5967042891 |
0.83 |
[C@]12(C)CCC3[C@@]([H])(CC([C@@]4([H])CC=CC[C@]34C)=O)C1CCC2[C@H](C)[C@@H](O)[C@H](O)[C@H](C)C(C)C |
|
| MCULE-2883797701 |
0.83 |
C1(CC2C3=CCC4C5(C(CCC4(C)C3(C)CCC2(C(=O)O)CC1)C(CO)(C)C(O)C(O)C5)C)(C(=O)OC)C |
|
| MCULE-9038165616 |
0.83 |
CC(C(O)=O)CC1C2C=CC(CC2)C1 |
|
| MCULE-9625022025 |
0.83 |
CC1CCC(C(=O)O)(C)CC=1 |
|
| MCULE-8500547238 |
0.83 |
CC1CC(C2(C(O)=O)CC=CC2)CCC1 |
|
| MCULE-4851646103 |
0.83 |
CC1CCC(C2(C(O)=O)CC=CC2)CC1 |
|
| MCULE-5267198059 |
0.83 |
OC(C1(CC=CC1)CC1CCCCC1)=O |
|
| MCULE-6641232569 |
0.83 |
CC(C(O)=O)(CC1C2C=CC(CC2)C1)C |
|
| MCULE-5544927487 |
0.83 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])C[C@@](C)(C(OC)=O)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O |
|
| MCULE-7677256646 |
0.83 |
OC(C1(CC=CC1)CC1CCCC=1)=O |
|
| MCULE-8056155072 |
0.83 |
C1CC2(C)C3CC=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C(=O)O)(C)C1O |
|
| MCULE-3212175174 |
0.83 |
C1(C)(CCC(=C(C)C1)C)C(O)=O |
|
| MCULE-2451101251 |
0.83 |
C12(C)C(C(C)CC(O)=O)CCC1C1C(CC2O)C2(C)CCC(CC2C=C1)O |
|
| MolPort-019-937-401 |
0.82 |
COc1ccc(cc1)-c1oc2cc3OCOc3c(OC)c2c(=O)c1OC |
|
| MolPort-001-741-112 |
0.82 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1 |
|
| MolPort-000-695-891 |
0.82 |
COc1cc(cc(OC)c1OC)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-019-937-401 |
0.82 |
COc1ccc(cc1)-c1oc2cc3OCOc3c(OC)c2c(=O)c1OC |
|
| MolPort-046-761-065 |
0.82 |
COc1cc2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)c1OC |
|
| MolPort-039-338-850 |
0.82 |
COc1cccc(O)c1-c1cc(=O)c2c(O)cc(OC)c(OC)c2o1 |
|
| MolPort-023-298-915 |
0.82 |
COc1ccc(cc1)-c1oc2c(OC)c(OC(C)=O)cc(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-035-705-972 |
0.82 |
COc1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1 |
|
| MolPort-008-155-866 |
0.82 |
COc1ccc(cc1OC)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-004-955-681 |
0.82 |
Oc1ccc(cc1O)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-035-705-972 |
0.82 |
COc1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1 |
|
| MolPort-023-298-915 |
0.82 |
COc1ccc(cc1)-c1oc2c(OC)c(OC(C)=O)cc(OC(C)=O)c2c(=O)c1OC |
|
| MolPort-039-338-850 |
0.82 |
COc1cccc(O)c1-c1cc(=O)c2c(O)cc(OC)c(OC)c2o1 |
|
| MolPort-046-761-065 |
0.82 |
COc1cc2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)c1OC |
|
| MolPort-001-742-603 |
0.82 |
COc1cc(OC)c2c(c1)oc(-c1ccccc1)c(OC)c2=O |
|
| MCULE-5677861178 |
0.82 |
[C@H]1(C(O)=O)[C@]2([H])C[C@]([H])(C1)C=C2 |
|
| MCULE-5074709635 |
0.82 |
C1C[C@@]2([C@@]([H])([C@@](C(O)=O)(C)C1)CC[C@@]13C2=CC[C@]([H])(C(O)(CO)C1)C3)C |
|
| MCULE-2721005128 |
0.82 |
C1CC2(C(CC=1)(C(O)=O)CCCC2)CC(O)=O |
|
| MCULE-1857694923 |
0.82 |
[C@@]12([H])C[C@@]([H])(C=C1)C[C@@H]2C(O)=O |
|
| MCULE-2570487264 |
0.82 |
OC(C1C2C=CC(C2)C1)=O |
|
| MCULE-7173744939 |
0.82 |
C1C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C=C2[C@@H](C)C1 |
|
| MCULE-2253127357 |
0.82 |
C1(CC(C)=CCC1C(O)=O)C(O)=O |
|
| MCULE-3023348221 |
0.82 |
C1(C)(CC2CC1C=C2)C(O)=O |
|
| MCULE-5213682431 |
0.82 |
C1(C(O)=O)CC(C(C)C)=CCC1C(O)=O |
|
| MCULE-3724391729 |
0.82 |
C1(C(O)=O)CC(C)=C(CC1C(O)=O)C |
|
| MolPort-023-278-991 |
0.81 |
COc1cc(cc(O)c1OC)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-044-754-193 |
0.81 |
COc1c(O)c(O)c(O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-003-804-089 |
0.81 |
COc1c(O)c(O)c2c(oc(cc2=O)-c2ccccc2)c1OC |
|
| MolPort-001-740-873 |
0.81 |
COc1cc(ccc1O)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-035-706-534 |
0.81 |
COc1cc(O)c2c(oc(cc2=O)-c2ccccc2O)c1OC |
|
| MolPort-039-338-851 |
0.81 |
COc1cc(O)c2c(oc(cc2=O)-c2c(O)cccc2O)c1OC |
|
| MolPort-044-754-193 |
0.81 |
COc1c(O)c(O)c(O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-000-584-412 |
0.81 |
CCOc1c(oc2ccccc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-001-742-174 |
0.81 |
COc1cc(cc(OC)c1O)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-023-278-991 |
0.81 |
COc1cc(cc(O)c1OC)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-035-706-534 |
0.81 |
COc1cc(O)c2c(oc(cc2=O)-c2ccccc2O)c1OC |
|
| MolPort-039-338-851 |
0.81 |
COc1cc(O)c2c(oc(cc2=O)-c2c(O)cccc2O)c1OC |
|
| MCULE-8439103614 |
0.81 |
OC1C(C2(C(O)=O)CC=CC2)CCCC1 |
|
| MCULE-6962013531 |
0.81 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC(=O)[C@@]2([H])[C@@](C=O)(C)[C@H]1O |
|
| MCULE-7030538659 |
0.81 |
C12(C(=O)O)C3C4C5C1C=CC5C2(C(=O)O)C4C=C3 |
|
| MCULE-2960890696 |
0.81 |
C12C(C(=O)O)C3C4C(C(C(=O)O)C(C14)C=C2)C=C3 |
|
| MCULE-3655330509 |
0.81 |
OC(C(O)=O)CC1C2C=CC(CC2)C1 |
|
| MCULE-8721985369 |
0.81 |
OC(C1C2C(C(O)=O)C(C(O)=O)C(C=C2)C1C(O)=O)=O |
|
| MCULE-9499600420 |
0.81 |
C12CC1C1C(C(O)=O)C(C(O)=O)C2C=C1 |
|
| MCULE-3171016035 |
0.81 |
C1CCC2C(C(O)=O)C2C=CC1 |
|
| MCULE-5031139336 |
0.80 |
C12(C3C=CC1C(C3)C(O)=O)CC2 |
|
| MCULE-8179123738 |
0.80 |
[C@@H]1(C(=O)O)[C@]2([H])C=C[C@@]([H])(C2)[C@H]1C(=O)O |
|
| MCULE-8005965492 |
0.80 |
[C@]12(C)CC=C3[C@@]([H])(CC[C@@]4([H])CC(=O)CC[C@]34C)C1C[C@@H](C)[C@]2(O)C(CO)=O |
|
| MCULE-8919412541 |
0.80 |
C12CC(C(C(O)=O)C1C(O)=O)C=C2 |
|
| MCULE-9922742805 |
0.80 |
C(C)/C=C\CC(O)C(O)CCC(CCCCCCCC(O)=O)O |
|
| MCULE-8057091309 |
0.80 |
[C@@]1(C)(C(O)=O)[C@@H](C(O)=O)C2C=CC1C2 |
|
| MCULE-1190191150 |
0.80 |
OC(C1(CC1)CC1C2C=CC(CC2)C1)=O |
|
| MCULE-7400247321 |
0.80 |
C12C=CC(C)C1C2C(O)=O |
|
| MCULE-1536126723 |
0.80 |
C(O)(C1C(C2C3(CCCC3)C1C=C2)C(O)=O)=O |
|
| MCULE-9798718462 |
0.80 |
[C@@H]12C[C@H]([C@@H](C(O)=O)[C@@H]1C(O)=O)C=C2 |
|
| MolPort-046-790-441 |
0.80 |
COc1cc(OC)c2c(oc(cc2=O)-c2ccccc2)c1OC |
|
| MolPort-006-147-776 |
0.80 |
Oc1ccc(cc1O)-c1oc2cc(O)c(O)c(O)c2c(=O)c1O |
|
| MolPort-006-069-397 |
0.80 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-695-720 |
0.80 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-006-668-410 |
0.80 |
COc1cc(ccc1O)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-000-478-159 |
0.80 |
COc1ccc(cc1OC)-c1oc2c3ccccc3ccc2c(=O)c1O |
|
| MolPort-001-839-744 |
0.80 |
CC(=O)Oc1cc(O)c2c(c1)oc(-c1ccc(OC(C)=O)c(OC(C)=O)c1)c(OC(C)=O)c2=O |
|
| MolPort-039-101-243 |
0.80 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(O)c(OC)cc2o1 |
|
| MolPort-001-742-489 |
0.80 |
COc1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-035-705-971 |
0.80 |
COc1c(O)c2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)cc1 |
|
| MolPort-002-131-742 |
0.80 |
O.O.Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-000-674-523 |
0.80 |
O.Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-683-774 |
0.80 |
[2H]c1c([2H])c(c([2H])c(O)c1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-001-740-532 |
0.80 |
Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O |
|
| MolPort-001-740-557 |
0.80 |
Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-683-774 |
0.80 |
[2H]c1c([2H])c(c([2H])c(O)c1O)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-035-705-971 |
0.80 |
COc1c(O)c2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)cc1 |
|
| MolPort-046-790-441 |
0.80 |
COc1cc(OC)c2c(oc(cc2=O)-c2ccccc2)c1OC |
|
| MolPort-039-101-243 |
0.80 |
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(O)c(OC)cc2o1 |
|
| MolPort-001-741-309 |
0.80 |
COc1cc(O)c2c(oc(cc2=O)-c2ccccc2)c1OC |
|
| MCULE-1300466204 |
0.80 |
OC(=O)CC(O)C(C)C/C=C/CC(C)C(O)CC(=O)O |
|
| MCULE-2016404995 |
0.80 |
C(O)(CC1(C)C(CC=C2C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12)([H])C(O)=O)=O |
|
| MCULE-9205570843 |
0.80 |
C(O)(CC(=O)O)C(C/C=C\CCCCC)C(=O)O |
|
| MCULE-8918435387 |
0.80 |
C(O)(C12CCC(O)CC1(O)CCC1C3=CCC(C3(C)CCC21)C(O)=O)=O |
|
| MCULE-7136534003 |
0.80 |
CC=CCC1(C(O)=O)CC2(CCC2)C1 |
|
| MCULE-7057445911 |
0.80 |
C12C(C=CC1)C2C(O)=O |
|
| MCULE-3490312737 |
0.80 |
C/C(/C)=C\CC1(C(O)=O)CC2(CCC2)C1 |
|
| MCULE-2795374734 |
0.79 |
OC(C1(C2CCCC2)CC=CC1)=O |
|
| MCULE-5327458615 |
0.79 |
CC(C(=O)O)C1C2([H])C(CCC(=C2)C)([H])C(C)CC1 |
|
| MCULE-9571611941 |
0.79 |
OC(C1(CC=CC1)CC1CC2C(C2)C1)=O |
|
| MCULE-5025931577 |
0.79 |
C12CC=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)O)C)(C)C(=O)O |
|
| MCULE-5113003290 |
0.79 |
OC(C1CC2CC(CC=C2)C1)=O |
|
| MCULE-7147126046 |
0.79 |
C[C@@H](C(=O)O)[C@H]1[C@]2([H])[C@](CCC(=C2)C)([H])[C@H](C)CC1 |
|
| MCULE-1729412984 |
0.79 |
C(C1CCC=C1)(C(O)=O)C(O)=O |
|
| MCULE-9341616847 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)C[C@@H](C(O)=O)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O |
|
| MCULE-6699414453 |
0.79 |
CC1(CCCC1)CC1(C(O)=O)CC=CC1 |
|
| MCULE-6852628228 |
0.79 |
OC(C1(CC=CC1)CC1CCC1)=O |
|
| MCULE-4248274366 |
0.79 |
OC(C1(CC=CC1)CC1CCCC1)=O |
|
| MCULE-6540776662 |
0.79 |
CC1(CCC1)CC1(C(O)=O)CC=CC1 |
|
| MCULE-1391058013 |
0.79 |
C12(CC1)C1C=CC2C(C1C(O)=O)C(O)=O |
|
| MCULE-9929818229 |
0.79 |
[Na+].[Na+].C1C2CC(C(C([O-])=O)C2C([O-])=O)C=1 |
|
| MCULE-4504483614 |
0.79 |
C[C@H]1[C@@H]2CCC(C)=C[C@@H]2[C@H]([C@H](C(O)=O)C)CC1 |
|
| MCULE-3664047551 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)C[C@@H](C(O)=O)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O |
|
| MCULE-5820761773 |
0.79 |
OC(C1(C2CCCCCC2)CC=CC1)=O |
|
| MCULE-3699449483 |
0.79 |
OC(C1(C2CCC2)CC=CC1)=O |
|
| MCULE-1144217583 |
0.79 |
C1(C=O)CCC(CCCC(O)(C)C)=CC1 |
|
| MCULE-6215916748 |
0.79 |
OC(C1(CC=CC1)CC1CC1)=O |
|
| MolPort-000-165-394 |
0.79 |
COc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-046-683-310 |
0.79 |
COc1ccc(cc1OC)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-035-705-974 |
0.79 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-039-063-526 |
0.79 |
COc1ccc(cc1)-c1oc2cc(OC)cc(OC)c2c(=O)c1O |
|
| MolPort-005-310-458 |
0.79 |
COc1cc(cc(OC)c1O)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-023-278-998 |
0.79 |
COc1c(O)cc(cc1O)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-046-683-310 |
0.79 |
COc1ccc(cc1OC)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-035-705-974 |
0.79 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-001-742-461 |
0.79 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-046-153-728 |
0.79 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-002-510-609 |
0.79 |
CC(=O)Oc1cc(OC(C)=O)c2c(c1)oc(-c1ccc(OC(C)=O)c(OC(C)=O)c1)c(OC(C)=O)c2=O |
|
| MolPort-039-063-526 |
0.79 |
COc1ccc(cc1)-c1oc2cc(OC)cc(OC)c2c(=O)c1O |
|
| MolPort-009-753-911 |
0.79 |
COc1ccc(cc1O)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1 |
|
| MolPort-023-278-998 |
0.79 |
COc1c(O)cc(cc1O)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-046-153-728 |
0.79 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1cc(OC)c(OC)c(OC)c1 |
|
| MCULE-2506870963 |
0.78 |
C12(C)CCCC(C)(C(O)=O)C1CCC1CCC(O)CC2=1 |
|
| MCULE-7184031760 |
0.78 |
C[C@]12CC[C@@]3([H])C(C(=O)CC[C@]3(C)[C@]1([H])[C@H](CC1=C([C@H](C)C[C@H](O)[C@@H](O)C(O)(C)C)CC[C@]21C)O)(C)C |
|
| MCULE-1755461261 |
0.78 |
[C@]1(C)(CCC(=O)O)C2CC[C@]3([H])[C@@]([H])([C@@](O)(CC/C=C(\C)/C)C)CC[C@@]3(C)[C@]2(C)CC[C@H]1C(=C)C |
|
| MCULE-1918074338 |
0.78 |
C(C(=O)O)C[C@]1(C)C2=CC[C@@]3(C(=O)CC[C@@]3(C)[C@]2([H])CC[C@@]1([H])C(=C)C)C |
|
| MCULE-3556089734 |
0.78 |
C1=CC2C1C(C(O)=O)C2C(O)=O |
|
| MCULE-5859140606 |
0.78 |
CC1CC(C(O)=O)(CC2CC=CCC2)C1 |
|
| MCULE-7417377682 |
0.78 |
OC(C1(CC1)CC1CC=CCC1)=O |
|
| MCULE-6413909495 |
0.78 |
CCCCCCCC/C=C\CCCCCCC(C(=O)O)O |
|
| MCULE-8342191825 |
0.78 |
C1(=C(C)C)C2CCC1C(C2C(O)=O)C(O)=O |
|
| MCULE-6935719222 |
0.78 |
OC(C1C(CC2CC=CCC2)CCC1)=O |
|
| MCULE-1528374574 |
0.78 |
OC(C1(CCC1)CC1CC=CCC1)=O |
|
| MCULE-8030446235 |
0.78 |
[C@@H]1(O)C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C=C2[C@@H](C)[C@H]1O |
|
| MCULE-7270634760 |
0.78 |
OC(C1C(CC2CC=CCC2)CC1)=O |
|
| MolPort-039-338-670 |
0.78 |
COc1cc(O)cc2oc(-c3ccc(O)cc3)c(O)c(=O)c12 |
|
| MolPort-019-937-021 |
0.78 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-009-754-980 |
0.78 |
COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)c(O)c1 |
|
| MolPort-002-535-474 |
0.78 |
COc1c(O)c(O)c2oc(cc(=O)c2c1OC)-c1ccccc1 |
|
| MolPort-004-960-055 |
0.78 |
Oc1ccc2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O |
|
| MolPort-000-165-388 |
0.78 |
COc1cc(O)c2c(c1)oc(-c1ccc(O)cc1)c(O)c2=O |
|
| MolPort-039-338-670 |
0.78 |
COc1cc(O)cc2oc(-c3ccc(O)cc3)c(O)c(=O)c12 |
|
| MolPort-000-597-136 |
0.78 |
COc1ccc(cc1OC)-c1oc2cc(C)ccc2c(=O)c1O |
|
| MolPort-006-395-271 |
0.78 |
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1ccc(O)c(O)c1O |
|
| MolPort-000-774-377 |
0.78 |
COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1 |
|
| MolPort-000-676-302 |
0.78 |
COc1ccc2oc(cc(=O)c2c1)-c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-000-165-390 |
0.78 |
COc1ccc(cc1)-c1oc2cc(OC)cc(O)c2c(=O)c1O |
|
| MolPort-019-937-021 |
0.78 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-003-849-813 |
0.78 |
COc1cc(OC)c2c(c1)oc(cc2=O)-c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-000-695-889 |
0.78 |
COc1ccc(cc1OC)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-004-960-043 |
0.78 |
COc1cc(OC)c2c(c1)oc(cc2=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-019-998-217 |
0.77 |
Oc1ccc(cc1)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-000-598-823 |
0.77 |
COc1ccc(cc1OC)-c1oc2cc(C)cc(C)c2c(=O)c1O |
|
| MolPort-002-735-905 |
0.77 |
CCOc1ccc(cc1OCC)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-002-511-856 |
0.77 |
COc1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-603-304 |
0.77 |
CCOc1c(oc2cc(C)c(C)cc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-004-964-320 |
0.77 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(OC)c1 |
|
| MolPort-001-524-693 |
0.77 |
COc1cc(cc(OC)c1OC)-c1oc2ccc(Cl)cc2c(=O)c1O |
|
| MCULE-7592205580 |
0.77 |
C(/CCCCCC(C)CC)=C/CCCCC(O)=O |
|
| MCULE-3865951643 |
0.77 |
C1(C(O)=O)C(C)C(C)=CC(/C=C(/C)\C)C1C(O)=O |
|
| MCULE-8191255112 |
0.77 |
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O |
|
| MCULE-5258251736 |
0.77 |
C(O)(=O)C(CC=CCCCCCCCCCCCCC)CC(O)=O |
|
| MCULE-1831569032 |
0.77 |
C1(CC(CCC1C(O)=O)=CC/C=C(\C)/C)C(O)=O |
|
| MCULE-7369936803 |
0.77 |
[C@H]1(CC=CCC)C(CC[C@@H]1CC(O)=O)=O |
|
| MCULE-8374913301 |
0.77 |
CC1(C(C2(C(O)=O)CC=CC2)CCC1)O |
|
| MCULE-4320729921 |
0.77 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1=O |
|
| MCULE-6557448423 |
0.77 |
C12CC[C@@](O)(C)C1(C)CCC1C3CCC(=O)CC=3CCC21 |
|
| MCULE-1046270451 |
0.77 |
OC(CCCCCCCC=CCCCCCCCC(=O)O)=O |
|
| MCULE-4428892848 |
0.77 |
C1CCC2(C)C3CCC(C=C)(C)C=C3CCC2C1(C(=O)O)C |
|
| MCULE-1585586063 |
0.77 |
C12C(CCC(=O)C=1)CC(C(O)=O)C2 |
|
| MCULE-3248745724 |
0.77 |
C(CCCCCCCC)=CCCCCCCCCCCCC(=O)O |
|
| MCULE-9914820446 |
0.77 |
C(/CCCCCCC(C)C)=C/CCCCC(O)=O |
|
| MCULE-7702176615 |
0.77 |
CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O |
|
| MCULE-9024921933 |
0.77 |
OC(C(CC1C2C=CC(CC2)C1)=O)=O |
|
| MCULE-6492075764 |
0.77 |
C1CC2(C(CC=1)(C(O)=O)CCCC2)CCC#N |
|
| MCULE-6044533117 |
0.77 |
OC(CCCCCCC/C=C\CCCCCCCC)=O |
|
| MCULE-7761893081 |
0.77 |
C(CCCCCC(=O)O)CC/C=C\CCCCCCCC |
|
| MCULE-8054022250 |
0.77 |
C(CCCCCCCCC=CCCCCCC)(O)=O |
|
| MCULE-8798348917 |
0.77 |
C(CCCCCCC(=O)O)CCCCCC/C=C\CCCCCCCC |
|
| MCULE-6190365385 |
0.77 |
C(O)(CC1(C)C(CC(O)=O)(CC=C2C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC12)[H])=O |
|
| MCULE-9840181952 |
0.77 |
C1C[C@]2(C)[C@@]3([H])CC[C@](C=C)(C)C=C3CC[C@@]2([H])[C@@](C(=O)O)(C)C1 |
|
| MCULE-4871834352 |
0.77 |
OC(C1(CC=CC1)CC1(CCCC1)O)=O |
|
| MCULE-5541619791 |
0.77 |
[C@]12(C)CCC[C@@](C)(C(O)=O)[C@]1([H])CCC1=C[C@@](CC[C@]12[H])(C)C=C |
|
| MCULE-7400696054 |
0.77 |
C12C3C4C5C1C=CC5C2C4C(C(O)=O)C3C(O)=O |
|
| MCULE-2964563648 |
0.77 |
C1(C(C)C=CC(C)C1C(O)=O)C(O)=O |
|
| MCULE-6560423282 |
0.77 |
[C@H]1(CC(CC[C@@H]1C(O)=O)=CC/C=C(/C)\C)C(O)=O |
|
| MCULE-5077473579 |
0.77 |
C(CCCCCCC(=O)O)CCCC/C=C\CCCCCC |
|
| MCULE-3046418352 |
0.77 |
CCCCCCCC/C=C/CCCCCCCC(=O)O |
|
| MCULE-1243088880 |
0.77 |
C1=CC(C)C(C(=O)O)C(C(=O)O)C1 |
|
| MCULE-8928261768 |
0.77 |
C1C[C@]2(C)[C@@]3([H])CC[C@](C=C)(C)C=C3CC[C@@]2([H])[C@](C(=O)O)(C)C1 |
|
| MCULE-2674225616 |
0.77 |
OC1C(C2(C(O)=O)CC=CC2)CCC1 |
|
| MCULE-9547538729 |
0.77 |
CCCCCCCCC=CCCCCCCCC(O)=O |
|
| MCULE-2217416730 |
0.77 |
C1C(C)C(C(O)=O)(C)C(C(O)=O)CC=1 |
|
| MolPort-019-998-217 |
0.77 |
Oc1ccc(cc1)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O |
|
| MolPort-039-338-733 |
0.76 |
Oc1ccc(cc1)-c1oc2cc(O)c(O)c(O)c2c(=O)c1O |
|
| MolPort-035-705-969 |
0.76 |
COc1c(OC(C)=O)ccc(OC(C)=O)c1-c1cc(=O)c2c(OC(C)=O)cc(OC(C)=O)c(OC)c2o1 |
|
| MolPort-003-933-790 |
0.76 |
O.Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-023-279-002 |
0.76 |
CC(=O)Oc1ccc(cc1)-c1oc2cc(OC(C)=O)cc(O)c2c(=O)c1OC(C)=O |
|
| MolPort-046-687-437 |
0.76 |
COc1cc(ccc1O)-c1cc(=O)c2c(OC)cc(O)cc2o1 |
|
| MolPort-039-338-424 |
0.76 |
COc1cc2oc(cc(=O)c2c(O)c1O)-c1ccc(O)c(O)c1 |
|
| MolPort-046-703-081 |
0.76 |
C.Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-046-690-256 |
0.76 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(O)c2c(=O)c1OCOC |
|
| MolPort-046-690-256 |
0.76 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(O)c2c(=O)c1OCOC |
|
| MolPort-046-687-437 |
0.76 |
COc1cc(ccc1O)-c1cc(=O)c2c(OC)cc(O)cc2o1 |
|
| MolPort-046-703-081 |
0.76 |
C.Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-035-705-969 |
0.76 |
COc1c(OC(C)=O)ccc(OC(C)=O)c1-c1cc(=O)c2c(OC(C)=O)cc(OC(C)=O)c(OC)c2o1 |
|
| MolPort-006-393-842 |
0.76 |
[2H]C([2H])([2H])Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-603-263 |
0.76 |
COc1ccc(cc1OC)-c1oc2cc(C)c(C)cc2c(=O)c1O |
|
| MolPort-000-584-138 |
0.76 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OC |
|
| MolPort-023-279-002 |
0.76 |
CC(=O)Oc1ccc(cc1)-c1oc2cc(OC(C)=O)cc(O)c2c(=O)c1OC(C)=O |
|
| MolPort-000-695-890 |
0.76 |
CCOc1ccc(cc1OC)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-039-338-733 |
0.76 |
Oc1ccc(cc1)-c1oc2cc(O)c(O)c(O)c2c(=O)c1O |
|
| MolPort-000-675-875 |
0.76 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-000-882-130 |
0.76 |
Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-003-665-821 |
0.76 |
COc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-606-877 |
0.76 |
CCOc1c(oc2ccc(Cl)cc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-039-338-424 |
0.76 |
COc1cc2oc(cc(=O)c2c(O)c1O)-c1ccc(O)c(O)c1 |
|
| MCULE-8972335438 |
0.76 |
O=C1[C@]2(C)[C@](CC=C3[C@@]2([H])C[C@H](O)[C@@H](O)C3(C)C)([H])[C@@]2(C)[C@]([C@H]([C@@H](C2)O)[C@@](C)(O)C(=O)CCC(C)(O)C)(C)C1 |
|
| MCULE-2467601128 |
0.76 |
C1(CCCCCCCCCCCCC(=O)O)C=CCC1 |
|
| MCULE-2611969931 |
0.76 |
[C@@H]1(CCCCCCCCCCCCC(=O)O)C=CCC1 |
|
| MCULE-2546809155 |
0.76 |
CC(C(CC1C2C=CC(CC2)C1)=O)(O)C |
|
| MCULE-6262725586 |
0.76 |
OC(C1CC=CCC1)=O |
|
| MCULE-2991720663 |
0.76 |
C123C(C([H])(O)C1=O)(CC=CC2)CC=CC3 |
|
| MCULE-7930269142 |
0.76 |
C12C(C1/C(/C1CC21)=C(\C)/C)C(O)=O |
|
| MCULE-9797420475 |
0.76 |
OC([C@H]1CC=CCC1)=O |
|
| MCULE-5225374056 |
0.76 |
CC(C(CC1C2C=CC(CC2)C1)=O)O |
|
| MCULE-6793463685 |
0.76 |
O=C1CCC2(C)C(=C1)CCC1C(O)CCC(O)C21 |
|
| MCULE-6215840629 |
0.76 |
[C@H]1(C(O)=O)CCC=CC1 |
|
| MCULE-1597942572 |
0.76 |
OC([C@@H]1CC=CCC1)=O |
|
| MCULE-7139174666 |
0.76 |
C1CC(C(O)=O)(CC=C1)[H] |
|
| MCULE-2001524479 |
0.76 |
C[C@@]12[C@H]3CC=C4[C@H]5CC(C)(C)[C@@H](O)[C@H](O)[C@]5(CO)[C@H](O)C[C@@]4(C)[C@]3(C)CCC1[C@](CO)(C)[C@@H](O)CC2 |
|
| MCULE-1785744667 |
0.76 |
C1(C[C@@]2([H])[C@H](C)C[C@H](O)[C@H]([C@@]2([H])C=C1C)C(C)C)=O |
|
| MCULE-6199732071 |
0.76 |
C1(=O)C[C@@]2([H])[C@H](C)C[C@@H](O)[C@@H](C(C)C)[C@@]2([H])C=C1C |
|
| MCULE-7541730655 |
0.76 |
CC1(C)C2=CCC3C4(C)CC(O)C(C(O)(C(CCC(O)(C)C)=O)C)C4(C)CC(=O)C3(C)C2CC(O)C1O |
|
| MCULE-3222494622 |
0.76 |
C12CCC3C(C3CCC=CCCC1C2C(O)=O)C(O)=O |
|
| MCULE-1248316974 |
0.76 |
C/C(/C)=C/CCC1(CCC(=O)CC1)O |
|
| MCULE-4188975486 |
0.76 |
O=C(CCCCCCCC=CCCCCCCCC)[O-].[K+] |
|
| MCULE-4633610104 |
0.76 |
C(=O)(OC)C(C)(C)C1CC[C@@]2(C)[C@]3(C)CC[C@@]4(C(=O)O)CC[C@@H](C)[C@](O)(C)[C@@]4([H])C3=CCC2[C@@]1(C)CC(=O)O |
|
| MCULE-5009469360 |
0.76 |
[C@@H]1(C(O)=O)CCC=CC1 |
|
| MCULE-2893862044 |
0.76 |
[Na+].C(CCCCCC([O-])=O)CC=CCCCCCCCC |
|
| MolPort-003-724-691 |
0.75 |
Cc1c(O)cc(O)c2c1oc(-c1ccc(O)c(O)c1)c(O)c2=O |
|
| MolPort-001-529-372 |
0.75 |
COc1ccc(OC)c(c1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-035-705-973 |
0.75 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-039-338-552 |
0.75 |
COc1cc(O)c2c(c1)oc(-c1ccccc1)c(O)c2=O |
|
| MolPort-004-964-316 |
0.75 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(OC)c(O)c1 |
|
| MolPort-000-735-128 |
0.75 |
COc1ccc2c(c1)oc(cc2=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-000-606-878 |
0.75 |
COc1ccc(cc1OC)-c1oc2ccc(Cl)cc2c(=O)c1OC(C)C |
|
| MolPort-023-298-917 |
0.75 |
CC(=O)Oc1ccc(cc1)-c1oc2cc(OC(C)=O)cc(OC(C)=O)c2c(=O)c1OC(C)=O |
|
| MolPort-046-690-255 |
0.75 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(O)c2c(=O)c1O |
|
| MolPort-001-741-266 |
0.75 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1 |
|
| MolPort-003-938-578 |
0.75 |
[Cl-].COc1cc(cc(OC)c1O)-c1[o+]c2cc(O)cc(O)c2cc1O |
|
| MolPort-039-338-552 |
0.75 |
COc1cc(O)c2c(c1)oc(-c1ccccc1)c(O)c2=O |
|
| MolPort-035-705-973 |
0.75 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1 |
|
| MolPort-004-955-080 |
0.75 |
COc1cccc(c1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-000-695-730 |
0.75 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-002-121-337 |
0.75 |
COc1ccc2oc(cc(=O)c2c1)-c1ccc(OC)c(OC)c1 |
|
| MolPort-001-740-364 |
0.75 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(O)cc2o1 |
|
| MolPort-023-277-566 |
0.75 |
COc1cc(ccc1O)-c1oc2cc(C)c(C)cc2c(=O)c1O |
|
| MolPort-005-945-165 |
0.75 |
COc1ccc2oc(cc(=O)c2c1OC)-c1c(OC)cccc1OC |
|
| MolPort-023-277-566 |
0.75 |
COc1cc(ccc1O)-c1oc2cc(C)c(C)cc2c(=O)c1O |
|
| MolPort-046-690-255 |
0.75 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(O)c2c(=O)c1O |
|
| MolPort-023-298-917 |
0.75 |
CC(=O)Oc1ccc(cc1)-c1oc2cc(OC(C)=O)cc(OC(C)=O)c2c(=O)c1OC(C)=O |
|
| MCULE-4849477341 |
0.75 |
[C@]12(C)CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(CO)=C |
|
| MCULE-8463642691 |
0.75 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@](O)(C(CO)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O |
|
| MCULE-8646276663 |
0.75 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O |
|
| MCULE-6276076551 |
0.75 |
C(OC)(C1CCC2C1(C)CCC1C=2CCC2(O)CC(O)CCC21CO)=O |
|
| MCULE-9153738942 |
0.75 |
C(CCCCC=CC(C)C)(O)=O |
|
| MCULE-5186769141 |
0.75 |
C12(C)C[C@H](O)C3C(CCC4=CC(=O)CCC34C)C1C[C@@H](C)[C@]2(O)C(CO)=O |
|
| MCULE-4822409054 |
0.75 |
C12(C)C[C@@H](O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(CO)=O |
|
| MCULE-3304274375 |
0.75 |
C12=CCC(C)C1CC1(O)C(C)(CO)C2(C)CC1=O |
|
| MCULE-7510220469 |
0.75 |
C1CC2[C@@](CC[C@H]([C@]2(C)CCC(C)CC(=O)O)C)(C(=C1)CO)C |
|
| MCULE-4750287883 |
0.75 |
C1=CCC(C(O)=O)(C)C(C(C)=O)([H])C1 |
|
| MCULE-8120111177 |
0.75 |
C1CC(C)(C(=O)O)C([H])(C(=O)O)CC=1 |
|
| MCULE-2021957290 |
0.75 |
C(C)CCCCCCCCCCC(O)/C=C/CCC(=O)O |
|
| MCULE-7375016319 |
0.75 |
[C@H]12C(C=O)=C(C)[C@](C)(CC[C@@H]1C(C)C)C2C(O)=O |
|
| MCULE-9777116319 |
0.75 |
C1CC2(C(CCCC2)(CC=1)C(OC)=O)CCC(OC)=O |
|
| MCULE-2791131855 |
0.75 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(CO)=O)[H] |
|
| MCULE-8208403883 |
0.75 |
C1(CC=CCC1C(O)=O)C(O)=O |
|
| MCULE-7062667000 |
0.75 |
[C@@H]1(CC=CC[C@H]1C(O)=O)C(O)=O |
|
| MCULE-6809736977 |
0.75 |
COC(C1C2C=CC(CC2)C1)=O |
|
| MCULE-5277132939 |
0.75 |
C1[C@@H](C(O)=O)[C@H](C(O)=O)CC=C1 |
|
| MCULE-7100298727 |
0.75 |
COC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O |
|
| MCULE-8953627920 |
0.75 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H] |
|
| MolPort-001-740-838 |
0.74 |
COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccc(O)cc1 |
|
| MolPort-046-156-405 |
0.74 |
COc1ccc(cc1Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-123-870 |
0.74 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OCC(C)=O |
|
| MolPort-001-741-568 |
0.74 |
Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-001-015-460 |
0.74 |
Oc1c(oc2ccccc2c1=O)-c1ccc2OCOc2c1 |
|
| MolPort-000-779-119 |
0.74 |
COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)cc1 |
|
| MolPort-000-606-848 |
0.74 |
COc1ccc(cc1OC)-c1oc2ccc(Cl)cc2c(=O)c1O |
|
| MolPort-000-580-608 |
0.74 |
COc1ccc(cc1OC)-c1oc2c(C)cc(C)cc2c(=O)c1O |
|
| MolPort-046-419-261 |
0.74 |
Oc1c(oc2ccccc2c1=O)-c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 |
|
| MolPort-023-298-908 |
0.74 |
COc1c(OC(C)=O)cc(O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-046-153-796 |
0.74 |
COc1cc(OC)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |
|
| MolPort-006-113-296 |
0.74 |
[Cl-].COc1cc(cc(O)c1O)-c1[o+]c2cc(O)cc(O)c2cc1O |
|
| MolPort-008-821-910 |
0.74 |
COc1ccc2c(c1)oc(cc2=O)-c1ccc(O)c(OC)c1 |
|
| MolPort-039-141-781 |
0.74 |
COc1c(O)cc2oc(-c3ccc(O)c(CCC(C)CO)c3)c(OC)c(=O)c2c1O |
|
| MolPort-000-603-264 |
0.74 |
COc1ccc(cc1OC)-c1oc2cc(C)c(C)cc2c(=O)c1OC(C)=O |
|
| MolPort-046-419-261 |
0.74 |
Oc1c(oc2ccccc2c1=O)-c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 |
|
| MolPort-046-156-405 |
0.74 |
COc1ccc(cc1Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-023-298-908 |
0.74 |
COc1c(OC(C)=O)cc(O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-046-153-796 |
0.74 |
COc1cc(OC)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |
|
| MolPort-046-793-184 |
0.74 |
Cl.COc1cc(O)c2cc(O)c([o+]c2c1)-c1cc(OC)c(O)c(OC)c1 |
|
| MolPort-039-141-781 |
0.74 |
COc1c(O)cc2oc(-c3ccc(O)c(CCC(C)CO)c3)c(OC)c(=O)c2c1O |
|
| MolPort-046-793-184 |
0.74 |
Cl.COc1cc(O)c2cc(O)c([o+]c2c1)-c1cc(OC)c(O)c(OC)c1 |
|
| MolPort-001-740-950 |
0.74 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |
|
| MolPort-000-695-888 |
0.74 |
COc1ccc(OC)c(c1)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MCULE-3473010637 |
0.74 |
O=C1CCC2(C)C3C(O)CC4(C)CCCC4C3CCC2=C1 |
|
| MCULE-6821384626 |
0.74 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)C(CO)(O)[H] |
|
| MCULE-7311176198 |
0.74 |
C(=O)(O)CCCCCCCC(O)C(O)C(O)/C=C\CCCCC |
|
| MCULE-4976051850 |
0.74 |
[C@]12(C)C[C@@H]([C@H](O)[C@@](C)(C(=O)O)[C@]1([H])CC[C@@]1(C)C3CC[C@@]4(C(=O)O)CCC(C)(C)C[C@@]4([H])C=3[C@@H](CCl)C[C@]21[H])O |
|
| MCULE-6438933973 |
0.74 |
CC(C(CC1CC=CCC1)=O)(O)C |
|
| MCULE-8828485995 |
0.74 |
C[C@]12CC[C@@]3([H])C(C(=O)CC[C@]3(C)[C@]1([H])[C@H](CC1=C([C@H](C)C[C@H](O)[C@@H](O)C(=C)C)CC[C@]21C)O)(C)C |
|
| MCULE-8721851502 |
0.74 |
[C@@]12(C)C[C@@H](O)[C@@H]([C@](C)(CCC(C)(O)C=C)[C@@]1([H])CC(=O)C=C2C)C |
|
| MCULE-7713771264 |
0.74 |
[C@]12(C)C[C@@H]([C@H](O)[C@@](C)(C(=O)O)[C@]1([H])CC[C@@]1(C)C3CC[C@@]4(C(=O)O)CCC(C)(C)C[C@@]4([H])C=3[C@@H](CCl)C[C@]21[H])O |
|
| MCULE-6829909415 |
0.74 |
C(C(=O)O)C[C@]1(C)C2CC[C@]3(C)[C@@]([H])([C@H](C(=O)O)CC/C=C(/C)\C)[C@H](O)C[C@@]3(C)C=2CC[C@@]1([H])C(=C)C |
|
| MCULE-2458381576 |
0.74 |
C1C2C(=O)C(CC(C(=O)O)C2)C=C1 |
|
| MCULE-2170508823 |
0.74 |
C12C3C4C5C1C(C1C5C(C4CC3CC(O)=O)CC1CC(O)=O)C=C2 |
|
| MCULE-1877150050 |
0.74 |
C12(C)CCC(O)CC1=CCC1C2CCC2(C)C(CCC21)(O)CCC(O)=O |
|
| MCULE-1202438669 |
0.74 |
C1C=CCCC(C(O)=O)CC1 |
|
| MCULE-4002345426 |
0.74 |
C1(CCCC(=CCC2C(C)(CCC2C(=C)C)CC1)C)C(=O)O |
|
| MCULE-9679346580 |
0.74 |
C(O)(C1C2C(=C(C)C)C(C=C2)C1C(O)=O)=O |
|
| MCULE-9707443606 |
0.74 |
C1C[C@]2(C)[C@@]3([H])C(=O)C=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1O |
|
| MCULE-9341959688 |
0.74 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])C[C@@]1([H])CC=CC[C@@]21C(C)=O)[H] |
|
| MCULE-8327830017 |
0.74 |
C1CC2(C)C3CCC4=C(C(CC(O)C(O)C(O)(C)C)C)C(O)CC4(C)C3(C)CCC2C(C)(C)C1=O |
|
| MCULE-4134342158 |
0.74 |
[C@@]12([H])[C@@H](C)C[C@@H](O)[C@@H](C(O)(C)C)CC1=C(C)C(=O)C2 |
|
| MCULE-2700455616 |
0.74 |
C1CC2(C)C3C(=O)C=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C)(C(=O)O)C1O |
|
| MCULE-7543238538 |
0.74 |
C(O)(=O)CCC1C(=O)CCCC=1 |
|
| MCULE-4980717954 |
0.74 |
C1CC(C)(CC(O)=O)C(C)(CC(=O)O)CC=1 |
|
| MolPort-039-338-213 |
0.73 |
COc1c(O)cc2oc(-c3ccc(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-035-717-065 |
0.73 |
Cc1ccc2oc(-c3ccc4OCOc4c3)c(O)c(=O)c2c1 |
|
| MolPort-035-683-137 |
0.73 |
COc1c(O)cc2oc(-c3cc(CC=C(C)C)c(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-046-153-746 |
0.73 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(OC)cc2o1 |
|
| MolPort-046-687-434 |
0.73 |
COc1cc(O)cc2oc(cc(=O)c12)-c1ccc(O)c(O)c1 |
|
| MolPort-023-279-015 |
0.73 |
COc1c(OC(C)=O)cc(OC(C)=O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-004-955-680 |
0.73 |
Oc1ccc(cc1O)-c1cc(=O)c2ccc(O)c(O)c2o1 |
|
| MolPort-046-506-359 |
0.73 |
Oc1cc(cc(O)c1O)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-035-717-065 |
0.73 |
Cc1ccc2oc(-c3ccc4OCOc4c3)c(O)c(=O)c2c1 |
|
| MolPort-004-955-145 |
0.73 |
COc1ccc(cc1)-c1oc2ccc(OC)cc2c(=O)c1O |
|
| MolPort-000-705-303 |
0.73 |
COc1c(oc2ccccc2c1=O)-c1ccccc1 |
|
| MolPort-000-699-216 |
0.73 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-000-676-312 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCc3cccc4ccccc34)ccc2o1 |
|
| MolPort-003-935-844 |
0.73 |
[Cl-].COc1cc(ccc1O)-c1[o+]c2cc(O)cc(O)c2cc1O |
|
| MolPort-001-742-584 |
0.73 |
Oc1ccc(c(O)c1)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MolPort-008-818-984 |
0.73 |
COc1ccc2oc(cc(=O)c2c1)-c1ccc(O)c(OC)c1 |
|
| MolPort-000-119-992 |
0.73 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OCC(N)=O |
|
| MolPort-035-683-137 |
0.73 |
COc1c(O)cc2oc(-c3cc(CC=C(C)C)c(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-046-506-359 |
0.73 |
Oc1cc(cc(O)c1O)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-039-338-213 |
0.73 |
COc1c(O)cc2oc(-c3ccc(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-000-123-871 |
0.73 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(C)C(C)=O |
|
| MolPort-023-279-015 |
0.73 |
COc1c(OC(C)=O)cc(OC(C)=O)c2c1oc(cc2=O)-c1ccccc1 |
|
| MolPort-000-670-205 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(C)ccc2o1 |
|
| MolPort-005-981-182 |
0.73 |
COc1cccc(c1)-c1cc(=O)c2c(OC)cc(OC)cc2o1 |
|
| MolPort-000-695-884 |
0.73 |
COc1cccc(c1)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-046-687-434 |
0.73 |
COc1cc(O)cc2oc(cc(=O)c12)-c1ccc(O)c(O)c1 |
|
| MolPort-003-845-114 |
0.73 |
Oc1c(oc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2c1=O)-c1ccc(OCc2ccccc2)cc1 |
|
| MolPort-000-676-309 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCCCOc3cccc(C)c3)ccc2o1 |
|
| MolPort-046-153-746 |
0.73 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(OC)cc2o1 |
|
| MolPort-000-676-303 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCC=C)ccc2o1 |
|
| MolPort-000-676-304 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCC#N)ccc2o1 |
|
| MolPort-000-676-308 |
0.73 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCCOc3ccc(C)cc3)ccc2o1 |
|
| MolPort-016-633-332 |
0.73 |
O.Oc1ccc(c(O)c1)-c1oc2cc(O)cc(O)c2c(=O)c1O |
|
| MCULE-2653535248 |
0.73 |
C1(CC2C(C(=C1)C)(CCC(C2(CCC(C)CC(=O)O)C)C)C)=O |
|
| MCULE-5424518807 |
0.73 |
C1=CCC2(C(C1)(CC#N)CCCC2)C(O)=O |
|
| MCULE-3305395898 |
0.73 |
C12C3C4C5C1C(C1C5C5C4C(C(O)C5C1=O)C3=O)C=C2 |
|
| MCULE-8429170945 |
0.73 |
C1C(CC(O)=O)C(C=C)CC=1 |
|
| MCULE-9075563464 |
0.73 |
O=C1C2C(CC(O)=O)CC(C=2C(C)(C)CC1)=O |
|
| MCULE-9085462824 |
0.73 |
OC(C1C(CC2CC=CC2)CCCC1)=O |
|
| MCULE-2605863241 |
0.73 |
C1C[C@@]2(C)C(C(C=C([C@@H]2CC[C@H](C)CC(O)=O)C)=O)C(C1)(C)C |
|
| MCULE-8974284912 |
0.73 |
CCC(C1(C(O)=O)CC=CC1)C |
|
| MCULE-9073699986 |
0.73 |
[C@]12([H])[C@](CO)(C)C=C(CO)[C@]1(C)[C@@]1([H])CC=C3[C@]4([H])[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC[C@@]3(C)[C@]1(C)CC2 |
|
| MCULE-4275950574 |
0.73 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)C(O)=O |
|
| MCULE-8671876949 |
0.73 |
C12CC(C3C(=O)C(O)C13)C=C2 |
|
| MCULE-8312923448 |
0.73 |
C12CCCC(=O)C=1CC(C(=O)O)CC2 |
|
| MCULE-2671029853 |
0.73 |
[C@@]12([H])CC[C@H]([C@H](C)CCC(=O)O)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H] |
|
| MCULE-2911613762 |
0.73 |
[C@H]1(C[C@H]2C[C@@H]1C=C2)CC(O)=O |
|
| MCULE-1455068472 |
0.73 |
C1C[C@]2(C)[C@@]3([H])CCC(=O)C=C3CC[C@@]2([H])[C@](C)(C(=O)O)C1 |
|
| MCULE-4819154807 |
0.73 |
C1C[C@@]2(C)C(CC(C(=C2CCC(C)CC(O)=O)C)=O)C(C1)(C)C |
|
| MCULE-3141539281 |
0.73 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCC(O)=O |
|
| MCULE-5059257985 |
0.73 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC(O)=O)CC3)CC=2 |
|
| MCULE-4899138148 |
0.73 |
C1C2C3([H])C(C2(C(O)=O)C(O)(C)C)C=CC3C=1 |
|
| MCULE-9209606443 |
0.73 |
C1CC2C(CCC(=O)O)C(C)C(=O)C=C2CC1 |
|
| MCULE-5390747778 |
0.73 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(O)=O)[H] |
|
| MCULE-2313378449 |
0.73 |
C(O)(C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O |
|
| MCULE-3216123627 |
0.73 |
C1CC(C(C1(CC(=O)O)C)CC/C(=C/CCC(=O)C)/CO)C(C)(C)O |
|
| MCULE-2637255261 |
0.73 |
C1C2C=CC3C(C(O)=O)C(C23)C=1 |
|
| MCULE-5797410500 |
0.73 |
O=C1CCC2(C)C3C(O)CC4(C)C(O)(CCC4C3CCC2=C1)C(C)=O |
|
| MCULE-5773428311 |
0.73 |
C1C[C@]2(C)C3C(CCC2[C@](C)(C(O)=O)C1)=CC(=O)CC3 |
|
| MCULE-4777198621 |
0.73 |
CCCCC/C=C\CCCCCC(C(=O)O)C(O)CC(=O)O |
|
| MCULE-7654868641 |
0.73 |
CC(C(C1(C(O)=O)CC=CC1)C)C |
|
| MolPort-019-936-735 |
0.72 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1 |
|
| MolPort-019-937-219 |
0.72 |
COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccccc1 |
|
| MolPort-035-717-040 |
0.72 |
COc1ccc(OC)c(c1)-c1oc2ccccc2c(=O)c1OC(C)=O |
|
| MolPort-035-946-519 |
0.72 |
CCOc1ccc2oc(-c3ccc(OC)cc3)c(O)c(=O)c2c1 |
|
| MolPort-000-675-862 |
0.72 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(=O)c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-035-717-040 |
0.72 |
COc1ccc(OC)c(c1)-c1oc2ccccc2c(=O)c1OC(C)=O |
|
| MolPort-035-946-519 |
0.72 |
CCOc1ccc2oc(-c3ccc(OC)cc3)c(O)c(=O)c2c1 |
|
| MolPort-004-960-119 |
0.72 |
COc1ccc(cc1OC)-c1cc(=O)c2ccc3ccccc3c2o1 |
|
| MolPort-019-936-735 |
0.72 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1 |
|
| MolPort-002-510-918 |
0.72 |
Cc1ccc2oc(-c3ccc4OCCOc4c3)c(O)c(=O)c2c1 |
|
| MolPort-005-945-542 |
0.72 |
Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1O |
|
| MolPort-001-741-265 |
0.72 |
COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccccc1 |
|
| MolPort-001-834-495 |
0.72 |
COc1cccc(c1OC)-c1oc2ccccc2c(=O)c1OC(C)=O |
|
| MolPort-002-744-577 |
0.72 |
Cc1ccc2c(c1)oc(-c1ccc3OCOc3c1)c(O)c2=O |
|
| MolPort-005-944-777 |
0.72 |
COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccccc1 |
|
| MolPort-004-955-345 |
0.72 |
COc1ccc(c(OC)c1)-c1cc(=O)c2cc(OC)ccc2o1 |
|
| MolPort-000-676-310 |
0.72 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCCCCOc3cccc(C)c3)ccc2o1 |
|
| MolPort-005-945-453 |
0.72 |
COc1ccc2oc(cc(=O)c2c1OC)-c1ccccc1OC |
|
| MolPort-000-674-965 |
0.72 |
CCOc1ccc(cc1OC)-c1oc2c(C)cc(C)cc2c(=O)c1O |
|
| MolPort-000-675-859 |
0.72 |
CCOC(=O)Oc1c(oc2ccccc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-000-695-729 |
0.72 |
COc1ccc(cc1OC)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-004-955-100 |
0.72 |
Oc1ccc(cc1O)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-000-707-019 |
0.72 |
COc1cc(ccc1O)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-019-937-219 |
0.72 |
COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccccc1 |
|
| MolPort-001-740-694 |
0.72 |
Oc1cc(O)c2c(c1)oc(-c1ccccc1)c(O)c2=O |
|
| MCULE-4823405948 |
0.72 |
[C@]12([H])[C@@H](O)C[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CCC1=CC(CC[C@]21C)=O)=O |
|
| MCULE-1652773504 |
0.72 |
C1(/CCC(C/1)C(O)=O)=C(\C)/C |
|
| MCULE-8991093142 |
0.72 |
OC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC |
|
| MCULE-9848650209 |
0.72 |
O[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C)CC[C@@](C(=O)O)(C)C[C@H]4C3=CC([C@@H]12)=O |
|
| MCULE-2735934269 |
0.72 |
OC1(C(CC2CC=CCC2)=O)CCCC1 |
|
| MCULE-1873537798 |
0.72 |
C([C@H]1CCC(=O)[C@@H]1CCCCCCC(O)=O)=C[C@H](CCCCC)O |
|
| MCULE-4841780318 |
0.72 |
C1CC23CC=CCC2(C(O)C(=O)C3)CC=1 |
|
| MCULE-8712180858 |
0.72 |
CC(C(C1(C(O)=O)CC=CC1)C)O |
|
| MCULE-8807729080 |
0.72 |
[C@]12([H])[C@@H](O)C[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)=O |
|
| MCULE-5549502379 |
0.72 |
C12C3CC(C=C3)C1C2C(O)=O |
|
| MCULE-2506206785 |
0.72 |
[C@@]12(C)C(=O)CCC1[C@]1(C([C@H](O)C2)[C@@]2(C)CCC(C=C2CC1)=O)[H] |
|
| MCULE-7081720222 |
0.72 |
COC([C@H]1C2C=CC(CC2)[C@H]1C(O)=O)=O |
|
| MCULE-8827470848 |
0.72 |
CC(CC1(C(O)=O)CC=CC1)(O)C |
|
| MCULE-9156595873 |
0.72 |
C(CCCCC)C(O)CC=CCCCCCCCC(=O)O |
|
| MCULE-9853941800 |
0.72 |
CC1C2CCC(C)=CC2C(C(C(O)=O)=C)CC1 |
|
| MCULE-3741444667 |
0.72 |
C12C3C(C)(CCC(C)(C(O)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)O)C |
|
| MCULE-9935430898 |
0.72 |
C(C(CCCCCC)CC=CCCCCCCCC(OC)=O)(C)=O |
|
| MCULE-4676598997 |
0.72 |
C12[C@@]3([H])[C@](C)(CC[C@](C)(C(O)=O)C3)CC[C@@]1(C)[C@]1([C@]([H])(C(=O)C=2)[C@@]2(C)CC[C@@H](C(C)(C)[C@@]2(CC1)[H])O)C |
|
| MCULE-9549608104 |
0.72 |
C12C(=O)C=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)=O)C)(C)C(=O)O |
|
| MCULE-4586192863 |
0.72 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)=O |
|
| MCULE-4949013565 |
0.72 |
C(C1(C2=CCCCC2)CCCCC1)(O)=O |
|
| MCULE-8251556719 |
0.72 |
[C@H]1(C/C=C\CCO)C(CC[C@@H]1CC(=O)O)=O |
|
| MCULE-5701652206 |
0.72 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@@]2(O)CCC(=O)[O-] |
|
| MCULE-2582517969 |
0.72 |
C1C[C@@]2([H])[C@H](C)CC[C@@]([H])(C(C(=O)O)=C)[C@@]2([H])C=C1C |
|
| MCULE-9949303370 |
0.72 |
C(CO)(C1(O)CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O |
|
| MCULE-4690967590 |
0.72 |
C12(C)CCC(C=C1C(C)CC1([H])C3(C(C)(C(CC3)C(C)=O)CC(O)C21[H])[H])=O |
|
| MCULE-9036760572 |
0.72 |
[C@@H](O)(CCCCCC)CC=CCCCCCCCC(=O)O |
|
| MCULE-3238309101 |
0.72 |
C12(CCC(C(C(=O)O)C1C(=O)O)C=C2)C(=O)O |
|
| MCULE-7329243914 |
0.72 |
C12(CO)CCC(C(C)(CCC(C)CC(O)=O)C1CCC=C2CO)C |
|
| MCULE-7010605333 |
0.72 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(C)[C@@H](C(=O)C)CC3)C[C@@H]2C |
|
| MCULE-7472546811 |
0.72 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@]2(O)CCC(=O)[O-] |
|
| MolPort-046-689-626 |
0.71 |
COc1ccc(cc1OC(C)=O)-c1cc(=O)c2c(OC(C)=O)cc(OC(C)=O)cc2o1 |
|
| MolPort-039-141-962 |
0.71 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(CCC(C)CO)c1 |
|
| MolPort-039-338-553 |
0.71 |
COc1c(oc2c(CC=C(C)C)c(O)c(CC=C(C)C)c(O)c2c1=O)-c1ccc(O)c(O)c1 |
|
| MolPort-000-606-880 |
0.71 |
COc1ccc(cc1OC)-c1oc2ccc(Cl)cc2c(=O)c1OCC#N |
|
| MolPort-000-676-307 |
0.71 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCC(O)=O)ccc2o1 |
|
| MolPort-039-338-553 |
0.71 |
COc1c(oc2c(CC=C(C)C)c(O)c(CC=C(C)C)c(O)c2c1=O)-c1ccc(O)c(O)c1 |
|
| MolPort-039-141-962 |
0.71 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(CCC(C)CO)c1 |
|
| MolPort-000-676-305 |
0.71 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCC(N)=O)ccc2o1 |
|
| MolPort-002-734-901 |
0.71 |
CCOc1ccc(cc1OCC)-c1oc2cc(Cl)ccc2c(=O)c1O |
|
| MolPort-002-741-354 |
0.71 |
CCOc1ccc(cc1OC)-c1oc2cc(Cl)ccc2c(=O)c1O |
|
| MolPort-002-510-003 |
0.71 |
CC(=O)Oc1cc(OC(C)=O)c2c(c1)oc(cc2=O)-c1ccc(OC(C)=O)c(OC(C)=O)c1 |
|
| MolPort-046-689-626 |
0.71 |
COc1ccc(cc1OC(C)=O)-c1cc(=O)c2c(OC(C)=O)cc(OC(C)=O)cc2o1 |
|
| MolPort-001-742-474 |
0.71 |
COc1ccc2c(c1)oc(-c1ccccc1)c(O)c2=O |
|
| MolPort-006-148-905 |
0.71 |
Oc1ccc(cc1)-c1cc(=O)c2c(O)c(Oc3ccc(cc3)-c3cc(=O)c4c(O)cc(O)cc4o3)c(O)cc2o1 |
|
| MCULE-6089018925 |
0.71 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C(C)=O)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O |
|
| MCULE-7364976100 |
0.71 |
C1[C@@H](O)[C@]2(C)CC=C(C(C)C)C[C@@]2([H])[C@@](C)(O)C1 |
|
| MCULE-2538866374 |
0.71 |
C(C1C(C)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C)(=O)C |
|
| MCULE-7760721294 |
0.71 |
C1CC2(CCCCC2(CO)C(C)C=1)CO |
|
| MCULE-2615091969 |
0.71 |
O=C1C(C2CCCCC2)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C |
|
| MCULE-6626480267 |
0.71 |
C1CC2C(O)C3CC=CCC3C(O)C2CC=1 |
|
| MCULE-2449230661 |
0.71 |
C1(CC2CC1C=C2)C(OC)=O |
|
| MCULE-2403352810 |
0.71 |
C12=CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H] |
|
| MCULE-2054566768 |
0.71 |
[C@@]12(C)CC[C@]3(CCC(C)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)OC(C)=O)CC[C@@]21C)C)C(O)=O |
|
| MCULE-7832981899 |
0.71 |
C(OC)(=O)C1CCC(=CC1)C |
|
| MCULE-1547137893 |
0.71 |
C12CCC(C(C)CCCC(=O)C)C1(C)CCC1C3(C)CCC(O)CC3=CCC21 |
|
| MCULE-7920901589 |
0.71 |
C1C(C(=O)OC)(C)CC(C)=C(C)C1 |
|
| MCULE-6520929159 |
0.71 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@]([H])(C(CO)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O |
|
| MCULE-7829183730 |
0.71 |
O=C1C(C(C)C)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C |
|
| MCULE-4154375600 |
0.71 |
C12(C(CC=CC1)(CO)CCCC2)CO |
|
| MCULE-4690400847 |
0.71 |
C1(CCCCCCC(=O)O)CC[C@@H](O)C=1 |
|
| MCULE-7929696567 |
0.71 |
C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1O |
|
| MCULE-7277661521 |
0.71 |
C1C(O)C2(C)C3C(O)CC4(C)C(C(C)=O)=CCC4C3CC=C2CC1O |
|
| MCULE-1541926426 |
0.71 |
C1C[C@]2(C)C3=CC[C@@]4([C@@]([C@@H](C[C@@]4(C)C3=CC[C@@]2([H])C([C@H]1O)(C)C)O)([H])[C@H](C(O)=O)CCC(=C)C(C)C)C |
|
| MCULE-2410702763 |
0.71 |
C(O)(=O)CCCCC(O)CC(/C=C\C/C=C\CCCCC)O |
|
| MCULE-3629918410 |
0.71 |
O=C(CCC(C)C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)CC |
|
| MCULE-7720595428 |
0.71 |
C1[C@@]2(O)C=C[C@]3([C@]4([H])[C@@]5(C[C@]5([H])C(=O)[C@@]4(C)CC[C@]3([H])[C@@]2(C)CC[C@@H]1O)[H])[H] |
|
| MCULE-7446284675 |
0.71 |
C1=CC2CCC1C(CO)C2CO |
|
| MCULE-8869963478 |
0.71 |
C1(=O)CCC2(C)C3C(O)CC4(C)C(C(CO)=O)CCC4C3CCC2=C1 |
|
| MCULE-2196052177 |
0.71 |
[K+].C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@@]2(O)CCC(=O)[O-] |
|
| MCULE-2434156493 |
0.71 |
OC(C1(CC=CCC1)CC1(C#N)CC1)=O |
|
| MCULE-9672606479 |
0.71 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CCCC(C)=O |
|
| MCULE-9646499830 |
0.71 |
OC(C1(CC=CCC1)CC1C(F)(F)C1)=O |
|
| MCULE-1874567277 |
0.71 |
[C@@]12(C)[C@@H](C(CO)=O)CC[C@@]1([H])[C@]1([C@]([H])([C@@H](O)C2)[C@@]2(C)CCC(C=C2CC1)=O)[H] |
|
| MCULE-9526433855 |
0.71 |
[C@]12(C)CCC3[C@@]([H])(CC=C4CC(O)CC[C@]34C)C1C[C@@H](C)[C@]2(C)C(C)=O |
|
| MCULE-5277306782 |
0.71 |
O[C@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@H]2CC[C@]2(C)[C@@H](C(C)=O)CC[C@H]21 |
|
| MCULE-4269813571 |
0.71 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H] |
|
| MCULE-1479199763 |
0.71 |
C1(=O)C(C)=CCC(C(C)CC(=O)O)(C(C(C)C)=O)C1 |
|
| MCULE-2847349308 |
0.71 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC=O)CC3)CC=2 |
|
| MCULE-8041079323 |
0.71 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@]2(O)CCC(=O)[O-].[K+] |
|
| MCULE-9998305986 |
0.71 |
CC(CC1(C(O)=O)CC=CC1)=C |
|
| MCULE-6728895797 |
0.71 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CC1CCCCC21C(C)=O |
|
| MCULE-4006235073 |
0.71 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)=O |
|
| MCULE-6563356566 |
0.71 |
OC(C1(C2CC2)CC=CC1)=O |
|
| MCULE-4398945581 |
0.71 |
C12(C)CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O |
|
| MCULE-9335291007 |
0.71 |
CC1(C(=O)CC[C@@]2(C)[C@H]1CC=C1[C@@]3(C)[C@]([C@H]([C@@H](C3)O)[C@H](C(=O)O)CCC(C(C)C)=C)(C)CC=C12)C |
|
| MCULE-7491068561 |
0.71 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1C[C@@H](C)[C@@H]2C(C)=O |
|
| MCULE-7299298141 |
0.71 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H] |
|
| MCULE-3935898183 |
0.71 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1=O)(C)[C@@](O)(C(=O)CO)CC3)CC2 |
|
| MCULE-5998876996 |
0.71 |
O(C(C)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C(=O)O)CCC(C)(C)C[C@H]4C3=CC[C@@H]12 |
|
| MCULE-9405390567 |
0.70 |
C(CCCCCCC(=O)O)CC/C=C/C/C=C/CCCCC |
|
| MCULE-1660040884 |
0.70 |
C[C@]12CC[C@@]3([H])[C@](CCC4[C@]3(C)CCC(=O)C=4)([H])[C@]1([H])CC[C@@]2(O)C |
|
| MCULE-9083020972 |
0.70 |
C1C[C@@]2(C)CC[C@@H](C(O)(C)C)CC2=C(C)C1 |
|
| MCULE-8031195256 |
0.70 |
[C@]12(C(=C[C@@H](O)CC1)[C@@H](C[C@@]1([C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2([H])[C@H](C)CCC(O)=O)C)[H])O)C |
|
| MCULE-8721567365 |
0.70 |
[C@@]12(C)C(O)CC[C@@]1([H])[C@]1([C@@]([H])(C3CCC(C=C3CC1)=O)CC2)[H] |
|
| MCULE-3945869814 |
0.70 |
C12C(=O)C[C@H]([C@H](C)CCCC(C)C)[C@@]1(C)CCC1C=2CC[C@@]2([C@]1(C)CC[C@@H](O)C2)[H] |
|
| MCULE-2999920945 |
0.70 |
C12(C)C(C(C)CCC(OC)=O)CCC1C1C(CC2)C2(CCCCC2C=C1)C |
|
| MCULE-9697672273 |
0.70 |
CC(OC(C1C2C=CC(CC2)C1)=O)(C)C |
|
| MCULE-6464655857 |
0.70 |
C1C[C@@]2([H])[C@H](C)CC[C@@]([H])([C@@H](C)C(=O)O)[C@@]2([H])C(=O)C=1C |
|
| MCULE-1591105974 |
0.70 |
C12(CO)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)O |
|
| MCULE-4241274271 |
0.70 |
C1(=O)C[C@]2([H])[C@@](C)(CC[C@@](O)(C=C)C)[C@H](C)CC[C@@]2(C)C(C)=C1 |
|
| MCULE-8247739375 |
0.70 |
C12=CCC3C(C)(CCC4C(C(OC(C)=O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(OC)=O |
|
| MCULE-5274452426 |
0.70 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2(C)O)C)=O |
|
| MCULE-1509278335 |
0.70 |
[C@H]1(C(=C)C(=O)O)CC=C(CCC(=O)C)[C@@H](C)CC1 |
|
| MCULE-8155210029 |
0.70 |
C[C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)CC4=CC[C@@]3([H])[C@]1([H])CC[C@@H]2C(=O)CO |
|
| MCULE-9131674305 |
0.70 |
O=C1CCC2(C)C3CCC4(C)C(CO)CCC4C3CCC2=C1 |
|
| MCULE-1065645853 |
0.70 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CCC2(C)O)C)=O |
|
| MCULE-9942267030 |
0.70 |
C12(C)CC=C(C(CCCC(C)C)C(O)=O)CC1CCC1C3C(C)(CCC21)C(O)CC3 |
|
| MCULE-5702475533 |
0.70 |
C12(CCC(C1(C)C)(C([H])=C([H])C13CCC(C1(C)C)(C(O)=O)C3)C2)C(O)=O |
|
| MCULE-1480805765 |
0.70 |
CCOC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O |
|
| MCULE-6957829896 |
0.70 |
[C@]12(C)CCC(C(C(O)=O)C1CCC2C(C)CCCC(C)C)[C@@]1(C)CCC(C=C1)=O |
|
| MCULE-6301076627 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(C)=O)[H] |
|
| MCULE-1990275167 |
0.70 |
C12CCC3=C(CC)C(CCC3(C)C1CCC1(C)[C@](CCC21)(O)C)=O |
|
| MCULE-9082869288 |
0.70 |
CCCCC/C(/[H])=C(\[H])/C/C(/[H])=C(\[H])/C/C(/[H])=C(\[H])/C/C(/[H])=C(/[H])\CCCCCC(O)=O |
|
| MCULE-1988011337 |
0.70 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)C |
|
| MCULE-8824898935 |
0.70 |
C(CC(C(C)C)/C=C/C(=C)CCC(=O)O)C(=O)C |
|
| MCULE-5029800865 |
0.70 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)(C)C |
|
| MCULE-9917637884 |
0.70 |
[C@]12(CO)CC[C@@H](CC1=CC[C@]1([H])C2CC[C@]2(C1CCC2=O)C)O |
|
| MCULE-1294118086 |
0.70 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2O)C)=O |
|
| MCULE-8042162865 |
0.70 |
C(CCCCCCCC=CCC=CCC=CCC)(O)=O |
|
| MCULE-1438242882 |
0.70 |
C(O)(=O)C[C@@](CC/C=C(/C)\C)(C)[H] |
|
| MCULE-8877595522 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H] |
|
| MCULE-3841271177 |
0.70 |
C12(C)C(O)CCC1([H])C1([H])C([H])(C3([H])CCC(C=C3CC1)=O)CC2 |
|
| MCULE-6340408888 |
0.70 |
C1CC2(C)C3CCC(=C)C(CC(=O)O)C3(C)CCC2C(C)(C)C1 |
|
| MCULE-1153477483 |
0.70 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@](O)(C(=O)CO)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O |
|
| MCULE-2200029918 |
0.70 |
OC(C(C1C=CCCCCC1)C#N)=O |
|
| MCULE-3946245376 |
0.70 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2(C)O)C)=O |
|
| MCULE-5685325143 |
0.70 |
C12(C)CCC3(C([H])(CC=C4CC(O)CCC34C)C1([H])CCC2C(CO)=O)[H] |
|
| MCULE-3460278496 |
0.70 |
C12CCC(C=C1)CC2C(OCC)=O |
|
| MCULE-1657159254 |
0.70 |
[C@@]12(C)[C@@H](O)CC[C@@]1([H])[C@]1([C@@]([H])([C@H]3CCC(C=C3CC1)=O)CC2)[H] |
|
| MCULE-9071849084 |
0.70 |
C12(C)CCC3(C([H])(CC=C4CC(O)CCC34C)C1([H])CC(C)C2(O)C(C)=O)[H] |
|
| MCULE-6441405293 |
0.70 |
OC(C1(CC2C(C2)C1)CC1CC=CC1)=O |
|
| MCULE-1067345384 |
0.70 |
[C@]12(CO)C[C@@H]([C@]3([H])[C@@]4(C)CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@@H]2C(=O)CO)O |
|
| MCULE-2411412323 |
0.70 |
C1C[C@@]2([C@@]([H])([C@@](C(O)=O)(C)C1)CC[C@@]13C2=CC[C@]([H])(C(=C)C1)C3)C |
|
| MCULE-4464327459 |
0.70 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H](O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O |
|
| MCULE-4440606459 |
0.70 |
C1([H])(C(OC)=O)C2C3C4C1C=CC4C([H])(C(OC)=O)C3C=C2 |
|
| MCULE-5773937031 |
0.70 |
C12C3C=CC1C(C(OC)=O)(C)C1C=CC(C3(C(OC)=O)C)C12 |
|
| MCULE-8259872102 |
0.70 |
C(C)(C1C(O)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O |
|
| MCULE-4209942909 |
0.70 |
C(/C=C\C/C=C\C/C=C\CC)CCCCCCCCCCC(=O)O |
|
| MCULE-2705141143 |
0.70 |
[C@@]12(C)[C@@H](C)CCCC1=CC[C@H](C2)C(=C)C(O)=O |
|
| MCULE-2400907851 |
0.70 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(CO)=O |
|
| MCULE-3333652397 |
0.70 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2O)C)=O |
|
| MCULE-7682763192 |
0.70 |
[C@@]12(C)CC[C@@]3(CO)CC[C@@H](C)[C@H](C)[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@]12C |
|
| MCULE-5683974067 |
0.70 |
C1C[C@]2(C([C@](C(O)=O)(C)C1)CCC13C2CCC(C(CO)=C1)C3)C |
|
| MCULE-6594867113 |
0.70 |
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O |
|
| MCULE-1893075589 |
0.70 |
CCCCC/C=C\C/C=C\CCCCCCCC(=O)O |
|
| MCULE-2458465887 |
0.70 |
O=C(OC)CCC(C)C1CCC2C1(C)C(O)CC1C2CCC2C=CCCC21C |
|
| MCULE-9765892541 |
0.70 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O |
|
| MCULE-5701533038 |
0.70 |
C1(CC(C)=CC(C)C1C(O)=O)C(OC)=O |
|
| MolPort-035-705-967 |
0.70 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(C)c(OC)cc2o1 |
|
| MolPort-023-282-651 |
0.70 |
COc1cc(ccc1O)-c1oc2c(Br)cc(Br)cc2c(=O)c1O |
|
| MolPort-021-802-749 |
0.70 |
Cc1ccc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1 |
|
| MolPort-046-765-444 |
0.70 |
[2H]C([2H])([2H])Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(OCc3ccccc3)cc2o1 |
|
| MolPort-004-955-094 |
0.70 |
Oc1ccc(cc1)-c1oc2cc(O)ccc2c(=O)c1O |
|
| MolPort-001-742-473 |
0.70 |
COc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1 |
|
| MolPort-003-665-819 |
0.70 |
COc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1 |
|
| MolPort-000-656-215 |
0.70 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OC(C)=O |
|
| MolPort-035-705-967 |
0.70 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(C)c(OC)cc2o1 |
|
| MolPort-000-676-315 |
0.70 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCc3ccc(Br)cc3)ccc2o1 |
|
| MolPort-004-964-315 |
0.70 |
COc1ccc(cc1)-c1cc(=O)c2c(O)cc(OC)cc2o1 |
|
| MolPort-046-765-444 |
0.70 |
[2H]C([2H])([2H])Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(OCc3ccccc3)cc2o1 |
|
| MolPort-000-598-445 |
0.70 |
COc1ccc(cc1OC)-c1oc2c(C)cc(C)cc2c(=O)c1OCC(O)=O |
|
| MolPort-000-695-870 |
0.70 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(C)ccc2o1 |
|
| MolPort-002-904-409 |
0.70 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)cc(OC)cc2o1 |
|
| MolPort-021-802-749 |
0.70 |
Cc1ccc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1 |
|
| MolPort-003-665-808 |
0.70 |
Oc1cc(O)c2c(c1)oc(cc2=O)-c1cc(O)c(O)c(O)c1 |
|
| MolPort-004-960-042 |
0.70 |
Oc1cc(O)c2c(oc(cc2=O)-c2ccccc2)c1O |
|
| MolPort-008-821-339 |
0.70 |
COc1cc(ccc1O)-c1cc(=O)c2ccc3ccccc3c2o1 |
|
| MolPort-000-695-719 |
0.70 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-000-695-731 |
0.70 |
COc1cc(ccc1O)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-000-706-683 |
0.70 |
Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |
|
| MolPort-023-282-651 |
0.70 |
COc1cc(ccc1O)-c1oc2c(Br)cc(Br)cc2c(=O)c1O |
|
| MolPort-001-742-737 |
0.70 |
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1c(O)cccc1O |
|
| MolPort-000-584-678 |
0.70 |
CCCOc1c(oc2ccccc2c1=O)-c1cc(Br)c(OC)c(OC)c1 |
|
| MolPort-002-510-692 |
0.70 |
Cc1cc2oc(-c3ccc4OCCOc4c3)c(O)c(=O)c2cc1C |
|
| MCULE-9671518710 |
0.70 |
C(CCCCCCC/C=C/C/C=C/CCCCC)(O)=O |
|
| MCULE-4653646367 |
0.70 |
C(CCCCCCCC=CCC=CCCCCC)(O)=O |
|
| MCULE-5063748511 |
0.70 |
C12CCC3=CC([C@H](C)CC3(C)C1CCC1(C)[C@](CCC21)(O)C)=O |
|
| MCULE-3455137708 |
0.70 |
C(O)(CC(C)CC/C=C(/C)\C)=O |
|
| MCULE-7998597001 |
0.70 |
C[C@H]1[C@H]2[C@H]3[C@](C)(CC[C@@H]2[C@@H]2C(=CC(CC2)=O)C1)[C@](O)(C)CC3 |
|
| MCULE-1316925332 |
0.70 |
CC(OC(C1C2C=CC(CC2)C1)=O)C |
|
| MCULE-1620592725 |
0.70 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CO)CCC(C)C(C)C21[H])[H] |
|
| MCULE-4914143446 |
0.70 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@@H](CC[C@H](O)C(O)(C)C)C)CC[C@@]4(C)C=3C(=O)C[C@@]2([H])C(C)(C)C1=O |
|
| MCULE-3553508294 |
0.69 |
OC(C1C(CC2CC=CC2)CC1)=O |
|
| MCULE-2014291882 |
0.69 |
C(OCC)(C1CC=C2C1(C)CCC1C2CCC2(O)CC(O)CCC21CO)=O |
|
| MCULE-7009109930 |
0.69 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)CO)C)CCC4(C)C3=CCC2C(C)(C)C1=O |
|
| MCULE-9449984869 |
0.69 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O |
|
| MCULE-1579293561 |
0.69 |
CC/C=C\C/C=C\C(O)C(O)C(O)CCCCCCCC(=O)O |
|
| MCULE-1842199780 |
0.69 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@@H](CC[C@H](O)C(O)(C)C)C)CC[C@@]4(C)C=3C(=O)C[C@@]2([H])C(C)(C)[C@H]1O |
|
| MCULE-4786407254 |
0.69 |
C1CC2=C(C3(CCC(O)C(C(=O)O)C31)C)C(CC1(C(CCC21)C(O)C)C)O |
|
| MCULE-9611860953 |
0.69 |
C(O)(=O)[C@]12[C@@](C3=CC[C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC1)C)C)C(C)(C)[C@@H](OC(=O)[C@]13[C@@](C4=CCC6[C@]7(C)C(CC[C@]6([C@@]4(CC1)C)C)C(C)(C)C(=O)CC7)([H])[C@@H](C)[C@H](C)CC3)CC5)([H])[C@@H](C)[C@H](C)CC2 |
|
| MCULE-5507744017 |
0.69 |
C1([C@H](CO)C(=O)[C@H](O)[C@H](O)C1)/C=C/C=C/CCC |
|
| MCULE-8392723345 |
0.69 |
C12CC=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)O)C)(C)C(=O)OC |
|
| MCULE-1501068987 |
0.69 |
C1(C(CC(O)C1O)/C=C/C=C/CCC)C(=O)O |
|
| MCULE-4207394958 |
0.69 |
C1(C(C)=CC2C(C1(C)C(CCO)=O)C(C(=O)O)CC(C)(O)C2)/C(=C/CO)/C |
|
| MCULE-3172312748 |
0.69 |
C1C2(CCC2(CC=C1)C(OC)=O)C(OC)=O |
|
| MCULE-3516804753 |
0.69 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@H](C(C(O)O)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O |
|
| MCULE-9742304708 |
0.69 |
C1C(C(O)=O)=CC[C@@H](C(O)(C)C)C1 |
|
| MCULE-6499225679 |
0.69 |
CC(C(O)=O)(CC1CCCCC=1)N |
|
| MCULE-6482685801 |
0.69 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(O)C(O)(C)C)C)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O |
|
| MCULE-1720910553 |
0.69 |
[O-]C(=O)CCCCCCCC([H])=C([H])CC([H])=C([H])CCCCC.[Na+] |
|
| MCULE-2011201542 |
0.69 |
[C@]12(C)CCC([C@H](C(O)=O)C1CCC2C(C)CCCC(C)C)[C@@]1(C)CCC=CC1=O |
|
| MCULE-6884173238 |
0.69 |
CC1C(C(O)=O)(CC2CC=CC2)CCC1 |
|
| MCULE-4596209637 |
0.69 |
CC1CC(C(O)=O)(CC2CC=CC2)CC1 |
|
| MCULE-2620645862 |
0.69 |
[O-]C(=O)CCCCCCCC=CCC=CCCCCC.[K+] |
|
| MCULE-2896292130 |
0.69 |
OC(C1(CC1)CC1CC=CC1)=O |
|
| MCULE-3005532858 |
0.69 |
OC(C1(CCC1)CC1CC=CC1)=O |
|
| MolPort-000-676-422 |
0.69 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccccc1C |
|
| MolPort-000-698-931 |
0.69 |
CCOc1cc(ccc1O)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-003-722-801 |
0.69 |
COc1ccc2c(c1)oc(cc2=O)-c1ccc2OCCOc2c1 |
|
| MolPort-000-603-306 |
0.69 |
COc1ccc(cc1OC)-c1oc2cc(C)c(C)cc2c(=O)c1OCC(N)=O |
|
| MolPort-046-690-434 |
0.69 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(OCC=C(C)C)c2c(=O)c1OCOC |
|
| MolPort-000-695-883 |
0.69 |
COc1ccc(cc1)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-002-977-152 |
0.69 |
COc1ccc(OC)c(c1)-c1oc2cc(Cl)ccc2c(=O)c1O |
|
| MolPort-035-717-105 |
0.69 |
Oc1c(oc2ccc(Cl)cc2c1=O)-c1ccc2OCOc2c1 |
|
| MolPort-000-676-380 |
0.69 |
CCOc1c(oc2ccccc2c1=O)-c1ccc(C)cc1 |
|
| MolPort-000-676-439 |
0.69 |
COc1ccc(cc1Br)-c1oc2ccccc2c(=O)c1OC |
|
| MolPort-028-913-030 |
0.69 |
COc1ccc2c(oc(cc2=O)-c2ccc(F)cc2)c1OC |
|
| MolPort-002-243-750 |
0.69 |
COc1cc(OC)c(cc1OC)-c1c2cc(O)c(O)cc2oc2cc(=O)c(O)cc12 |
|
| MolPort-000-676-409 |
0.69 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCCOc1ccccc1 |
|
| MolPort-003-665-822 |
0.69 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)cc1 |
|
| MolPort-000-123-913 |
0.69 |
COCCNC(=O)COc1c(oc2ccccc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-000-676-306 |
0.69 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCCCc3ccccc3)ccc2o1 |
|
| MolPort-039-141-907 |
0.69 |
COc1cc2oc(cc(=O)c2c(O)c1C)-c1ccc(O)cc1 |
|
| MolPort-002-528-562 |
0.69 |
Oc1c(oc2ccc(Cl)cc2c1=O)-c1ccc2OCCOc2c1 |
|
| MolPort-002-510-589 |
0.69 |
Oc1c(oc2ccc(F)cc2c1=O)-c1ccc2OCCOc2c1 |
|
| MolPort-000-676-301 |
0.69 |
COc1ccccc1C(=O)Oc1ccc2oc(cc(=O)c2c1)-c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-003-722-782 |
0.69 |
COc1ccc2oc(cc(=O)c2c1)-c1ccc2OCCOc2c1 |
|
| MolPort-000-676-313 |
0.69 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCc3ccc(F)cc3)ccc2o1 |
|
| MolPort-000-675-861 |
0.69 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(=O)c1cccc(Br)c1 |
|
| MolPort-008-818-977 |
0.69 |
COc1cc(ccc1O)-c1cc(=O)c2ccc(C)cc2o1 |
|
| MolPort-000-676-410 |
0.69 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCCCOc1cccc(C)c1 |
|
| MolPort-004-955-030 |
0.69 |
COc1c(oc2c3ccoc3ccc2c1=O)-c1ccccc1 |
|
| MolPort-035-717-105 |
0.69 |
Oc1c(oc2ccc(Cl)cc2c1=O)-c1ccc2OCOc2c1 |
|
| MolPort-039-141-907 |
0.69 |
COc1cc2oc(cc(=O)c2c(O)c1C)-c1ccc(O)cc1 |
|
| MolPort-028-913-030 |
0.69 |
COc1ccc2c(oc(cc2=O)-c2ccc(F)cc2)c1OC |
|
| MolPort-046-690-434 |
0.69 |
COCOc1ccc(cc1)-c1oc2cc(OCOC)cc(OCC=C(C)C)c2c(=O)c1OCOC |
|
| MCULE-6153090139 |
0.68 |
C1C2CCC(CC2C=O)C=1 |
|
| MCULE-9093112563 |
0.68 |
CC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O |
|
| MCULE-2022303549 |
0.68 |
C1(=O)CCC2(C)C3C(O)CC4(C=O)C(C(CO)=O)CCC4C3CCC2=C1 |
|
| MCULE-3135517908 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(C)=O |
|
| MCULE-2036056204 |
0.68 |
C1CC2(C)C=C(C(=O)O)C(O)CC2C(C)(C)C1 |
|
| MCULE-5222768441 |
0.68 |
CC(C1(C(O)=O)CC=CCC1)CC#N |
|
| MCULE-7081301004 |
0.68 |
OC[C@H]1[C@H]2C=C[C@H](CC2)C1 |
|
| MCULE-5453524094 |
0.68 |
OC(C1CC(CC2CC=CC2)(O)C1)=O |
|
| MCULE-8437877954 |
0.68 |
CC(C#N)CC1(C(O)=O)CC=CCC1 |
|
| MCULE-8197236760 |
0.68 |
CC12CCC3([H])C4(CCC(=O)C=C4C(C)CC3([H])C1([H])CCC2(O)C(=O)C)C |
|
| MCULE-6552675485 |
0.68 |
C12(C)CCC(C=C1[C@H](CC1C3C(C)([C@@](CC3)(O)C(C)=O)CCC12)C)=O |
|
| MCULE-8156503872 |
0.68 |
OC[C@](O)([C@]1(CC[C@@]2(C(CC[C@]3([C@]2(C[C@@](C[C@]3(CO)C)(O)[H])C)[H])=C1)[H])C)[H] |
|
| MCULE-6305022030 |
0.68 |
C[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4[C@@H](C)C[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)C)C |
|
| MCULE-6148148354 |
0.68 |
C1(C)C(C(O)C2(CO)C(C)CC=CC2)CC=CC1 |
|
| MCULE-5054990207 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(CO)=O |
|
| MCULE-2026458872 |
0.68 |
C12(C)CC(CC(C)(CO)C1([H])CCC1=CC(C)(C(O)CO)CCC21[H])O |
|
| MCULE-2352400825 |
0.68 |
C12C(C(=O)OC)C(C(=O)OC)C(C(C(OC)=O)C1C(OC)=O)C=C2 |
|
| MCULE-3390693428 |
0.68 |
C12(C)CCC3C(C)(CCC(=O)C=3)C1(C)CCC1(C)C(CCC21C)C(CO)=O |
|
| MCULE-3038839535 |
0.68 |
C12C(C)(C)CCCC=1CC(C)C(CO)(CO)C2 |
|
| MCULE-8934502311 |
0.68 |
C1(=O)CCC2(C)C3CCC4(C)C(C(CO)=O)CCC4C3(C)CCC2=C1 |
|
| MCULE-3541967763 |
0.68 |
[C@]12(CCC(=O)O)C[C@@]31CC[C@]1(C)[C@@]([H])([C@@H](CC/C=C(\C)/C)C)CC[C@@]1(C)[C@]3([H])CC[C@@]2([H])C(=C)CO |
|
| MCULE-7223116058 |
0.68 |
CC(C#N)(CC1(C(O)=O)CC=CCC1)C |
|
| MCULE-7591106214 |
0.68 |
C1C(=O)C=C(C)[C@]2(CC[C@@]([H])([C@](O)(CO)C)C2)[C@@H]1C |
|
| MCULE-5560129850 |
0.68 |
C1C(=O)C=C(C)[C@]2(CC[C@@]([H])([C@@](O)(CO)C)C2)[C@@H]1C |
|
| MCULE-1387376761 |
0.68 |
C12CCC(O)C1(C)CCC1=CC(=O)CCC21 |
|
| MCULE-1897348776 |
0.68 |
O=C1C2CC=CCC2CC2CC=CCC21 |
|
| MCULE-1251158415 |
0.68 |
[C@@]12([H])CC[C@](O)(C(=O)C)[C@@]1(C)CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H] |
|
| MCULE-2260551226 |
0.68 |
C1(C(OC)=O)CC(C)=C(CC1C(OC)=O)C |
|
| MCULE-3688392585 |
0.68 |
O=C1C(O)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C |
|
| MCULE-1566569432 |
0.68 |
[C@]12(C)CCC(C=C1C(=O)CC1C3[C@@](C)([C@@](CC3)(CC)O)CCC12)=O |
|
| MCULE-8997971805 |
0.68 |
[C@]12(C)CCC(C=C1C(=O)CC1C3[C@@](C)([C@@](CC3)(C)O)CCC12)=O |
|
| MCULE-8107340389 |
0.68 |
C12CC(=O)C(C)=C1CC(C(C(=O)O)=C)C(O)CC2C |
|
| MCULE-1506005197 |
0.68 |
[C@H]1(O)C[C@@]2(C)[C@]3([H])CC[C@@]([C@@H](O)CO)(C)C=C3CC[C@]2([H])[C@](C)(CO)C1 |
|
| MCULE-3790245367 |
0.68 |
C1(CO)(CO)C(C)CC(=CC1C)C |
|
| MCULE-2232302900 |
0.68 |
C1(CC2CCC1C=C2)C(C)=O |
|
| MCULE-9921246997 |
0.68 |
O[C@H]1C[C@]2(C=O)[C@@H](C(CO)=O)CC[C@H]2[C@@H]2CCC3=CC(CC[C@]3(C)[C@H]21)=O |
|
| MCULE-2147959975 |
0.68 |
C1[C@@]2(C)C(CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@]2(O)C(C)=O)=CC(=O)C1 |
|
| MCULE-5670150971 |
0.68 |
C(/C=C\CC)C(C(O)/C=C/C(O)CCCCCCCC(=O)O)O |
|
| MCULE-4728366427 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(CO)=O)[H] |
|
| MCULE-1412596642 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(C)=O)[H] |
|
| MCULE-3046367928 |
0.68 |
C1=CC2C3C4C5C(C(OC)=O)(C2(C(OC)=O)C4C=C5)C13 |
|
| MCULE-4839802180 |
0.68 |
[C@@]12([H])CC[C@H](C(=O)CO)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CCC(=O)C=C3CC[C@@]21[H] |
|
| MolPort-000-674-995 |
0.68 |
COc1cc(cc(OC)c1OC)C(=O)Oc1c(oc2ccccc2c1=O)-c1ccccc1 |
|
| MolPort-000-597-010 |
0.68 |
COc1ccc(cc1)-c1oc2cc(C)ccc2c(=O)c1O |
|
| MolPort-000-695-732 |
0.68 |
CCOc1cc(ccc1O)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-035-946-515 |
0.68 |
CC(C)Oc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-039-338-231 |
0.68 |
COc1c(O)cc2oc(-c3cc(CCC(C)CO)c(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-039-141-959 |
0.68 |
COc1c(O)cc2oc(-c3cc(CCC(C)CO)c(O)c(CC(O)C(C)=C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-000-676-411 |
0.68 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC#N |
|
| MolPort-000-676-311 |
0.68 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCc3ccccc3Cl)ccc2o1 |
|
| MolPort-004-955-148 |
0.68 |
Oc1ccc2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |
|
| MolPort-002-508-323 |
0.68 |
COc1ccc2c(c1)oc(cc2=O)-c1ccc2OCCCCOc2c1 |
|
| MolPort-005-308-474 |
0.68 |
COc1ccc(OC)c(c1)-c1oc2ccc(Cl)cc2c(=O)c1OC(C)=O |
|
| MolPort-003-724-680 |
0.68 |
Oc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1 |
|
| MolPort-000-675-863 |
0.68 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(=O)C1CCCCC1 |
|
| MolPort-000-123-912 |
0.68 |
CCC(C)NC(=O)COc1c(oc2ccccc2c1=O)-c1ccc(OC)c(OC)c1 |
|
| MolPort-000-698-625 |
0.68 |
Oc1ccc2oc(cc(=O)c2c1)-c1ccc2OCOc2c1 |
|
| MolPort-000-676-386 |
0.68 |
Cc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1cccc2ccccc12 |
|
| MolPort-000-676-419 |
0.68 |
COC(=O)c1ccc(COc2c(oc3ccccc3c2=O)-c2ccc(OC)cc2)cc1 |
|
| MolPort-006-827-856 |
0.68 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(N)ccc2o1 |
|
| MolPort-046-763-607 |
0.68 |
COc1ccc2c(oc(cc2=O)-c2ccc(cc2)N(C)C)c1OC |
|
| MolPort-039-338-391 |
0.68 |
COc1cc(O)cc2oc(cc(=O)c12)-c1ccc(O)cc1 |
|
| MolPort-039-141-959 |
0.68 |
COc1c(O)cc2oc(-c3cc(CCC(C)CO)c(O)c(CC(O)C(C)=C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-039-338-231 |
0.68 |
COc1c(O)cc2oc(-c3cc(CCC(C)CO)c(O)c(CC=C(C)C)c3)c(OC)c(=O)c2c1O |
|
| MolPort-035-946-515 |
0.68 |
CC(C)Oc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-046-763-607 |
0.68 |
COc1ccc2c(oc(cc2=O)-c2ccc(cc2)N(C)C)c1OC |
|
| MolPort-046-688-827 |
0.68 |
Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(OCc3ccccc3)cc2o1 |
|
| MolPort-039-338-391 |
0.68 |
COc1cc(O)cc2oc(cc(=O)c12)-c1ccc(O)cc1 |
|
| MolPort-001-572-500 |
0.68 |
CCOc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-000-594-231 |
0.68 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OCC(=O)c1ccccc1 |
|
| MolPort-000-648-481 |
0.68 |
COc1cc(ccc1O)-c1cc(=O)c2cc(C)ccc2o1 |
|
| MolPort-046-688-827 |
0.68 |
Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(OCc3ccccc3)cc2o1 |
|
| MolPort-000-676-407 |
0.68 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC=C |
|
| MolPort-001-572-720 |
0.68 |
Oc1c(oc2cc(Cl)ccc2c1=O)-c1ccc2OCOc2c1 |
|
| MolPort-008-818-973 |
0.68 |
COc1cc(ccc1O)-c1cc(=O)c2c(C)cc(C)cc2o1 |
|
| MolPort-000-597-011 |
0.68 |
COc1ccc(cc1)-c1oc2cc(C)ccc2c(=O)c1OC(C)=O |
|
| MolPort-000-676-382 |
0.68 |
Cc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccccc1 |
|
| MolPort-000-695-886 |
0.68 |
CCOc1ccc(cc1)-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-000-596-637 |
0.67 |
CC(C)Oc1c(oc2cc(C)ccc2c1=O)-c1ccc(C)cc1 |
|
| MolPort-001-835-896 |
0.67 |
COc1cc(OC)c2c(c1)oc(cc2=O)-c1ccccc1 |
|
| MolPort-005-945-441 |
0.67 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)c1 |
|
| MolPort-000-676-423 |
0.67 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccc(cc1)C(=O)OC(C)C |
|
| MolPort-039-013-993 |
0.67 |
Oc1ccc(c(O)c1O)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-000-676-413 |
0.67 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC(O)=O |
|
| MolPort-000-676-421 |
0.67 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccc(Br)cc1 |
|
| MolPort-000-123-911 |
0.67 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OCC(=O)N1CCOCC1 |
|
| MolPort-001-833-399 |
0.67 |
CCOC(=O)COc1c(oc2ccccc2c1=O)-c1cccc(OC)c1OC |
|
| MolPort-008-818-978 |
0.67 |
COc1cc(ccc1O)-c1cc(=O)c2cc(C)c(C)cc2o1 |
|
| MolPort-000-675-872 |
0.67 |
Cc1ccccc1COc1c(oc2ccccc2c1=O)-c1ccccc1 |
|
| MolPort-002-903-705 |
0.67 |
COc1ccc(cc1)-c1cc(=O)c2ccc(O)cc2o1 |
|
| MolPort-019-846-889 |
0.67 |
Oc1cc(O)c2cc(O)c([o+]c2c1)-c1cc(O)c(O)c(O)c1 |
|
| MolPort-044-559-814 |
0.67 |
Oc1cc(O)c2cc(O)c([o+]c2c1)-c1ccc(O)c(O)c1 |
|
| MCULE-1068095495 |
0.67 |
OC1(CCC(=O)CC1)CC1CC=CC1 |
|
| MCULE-8932496355 |
0.67 |
C(C(=O)O)(CC(=O)O)C=CCCCCCCCCCCCCCCCC |
|
| MCULE-9469566080 |
0.67 |
C[C@@]12CC[C@@H](O)C(C)(C)[C@@]1([H])CCC1=C[C@@](CC[C@@]21[H])(C)[C@H](CO)O |
|
| MCULE-4051240768 |
0.67 |
C12C3CCC(=O)C3(C)CCC=1C1C(C)(CC2)CC(=O)CC1 |
|
| MCULE-1159166918 |
0.67 |
[C@]12(C)C[C@]([H])(O)[C@]3([C@@](C)(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](O)[C@]2(O)C(=O)O)[H] |
|
| MCULE-9190698368 |
0.67 |
O=C(CC1CCC(=O)C1CC=CCC)OC |
|
| MCULE-6713995732 |
0.67 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)C)C)CCC4(C)C3=CCC2C(C)(C)C1=O |
|
| MCULE-5781346358 |
0.67 |
C[C@@]1([C@@H](O)CO)C=C2CC[C@@H]3C(C)(C)[C@H](O)CC[C@@]3(C)[C@@H]2CC1 |
|
| MCULE-3465723245 |
0.67 |
[C@@H]1(CCC(=O)[C@@H]1CC=CCC)CC(=O)OC |
|
| MCULE-5860324516 |
0.67 |
C1=C[C@]2(C(=CC1=O)CC[C@@]1([H])[C@]3([H])CC[C@](O)(C(O)=O)[C@@]3(C)C[C@@H]([C@]21[H])O)C |
|
| MCULE-9029872817 |
0.67 |
C1(CCCCCCCO)C(=O)C[C@@H](O)C=1 |
|
| MCULE-9150714373 |
0.67 |
C1(C(C)(C)CCCC=1C)C(O)=O |
|
| MCULE-7258934827 |
0.67 |
C1C[C@@]2(C)[C@]([H])(/C=C/C(=O)C)C(=C)CC[C@]2([H])[C@](C(O)=O)(C)C1 |
|
| MCULE-1159475762 |
0.67 |
C(O)(=O)C(C=CCCCCCCCCCC)CC(O)=O |
|
| MCULE-9808053205 |
0.67 |
C[C@@H](C1=C2C[C@@H]([C@H]3[C@]4(CCC(C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1)=O)C)O)C[C@@H]([C@H](C(OC)(C)C)O)O |
|
| MCULE-8245989851 |
0.67 |
C12CC(C=C1)C(C(OC)=O)C2C(O)=O |
|
| MCULE-7226046270 |
0.67 |
C12C(CCC(O)C=1)CC(C(OC)=O)C2 |
|
| MCULE-3025026991 |
0.67 |
C[C@@]12[C@@](C#C)(O)CC[C@H]1[C@@H]1[C@@H](CC3=C([C@H]1CC2)CCC(=O)C3)C |
|
| MCULE-6471729935 |
0.67 |
C1CC2[C@@]3([H])CC[C@]4(C)[C@@](C#C)(O)CC[C@@]4([H])[C@]3([H])[C@H](C)CC=2CC1=O |
|
| MCULE-1085165933 |
0.67 |
[C@]12(C)CCC[C@](C)(C(=O)O)[C@]1([H])CCC(=C)[C@@H]2CCC(C)=CCO |
|
| MCULE-1705600426 |
0.67 |
C12C(CCC(=O)C=1)CC(C(OC)=O)C2 |
|
| MCULE-5533097898 |
0.67 |
C(CCCC(=O)OC)CCCC=CCCCCCC |
|
| MCULE-2266413616 |
0.67 |
C1CC(O)C2(C)CC2C(C(CC=C1C)(CO)C)O |
|
| MCULE-7244926496 |
0.67 |
CCC(C1(C(O)=O)CC=CCC1)C#N |
|
| MCULE-4995415924 |
0.67 |
C(CCC)CCCC/C=C\CCCCCCCC(=O)OC |
|
| MCULE-4589748840 |
0.67 |
NC(C(O)=O)CC1C2C=CC(CC2)C1 |
|
| MCULE-6534469638 |
0.67 |
C(CCCCC=CCCCC)CCC(=O)OC |
|
| MCULE-8919059903 |
0.67 |
CCCCCCC(=O)CCCCCC/C=C/C[C@@H]([C@@H]([C@](C(=O)O)(N)CO)O)O |
|
| MCULE-5049706558 |
0.67 |
C1(CC(O)=O)(C(O)CCC(=O)C1)C/C=C(\C)/CC(/C=C(\C)/C)=O |
|
| MCULE-1038909539 |
0.67 |
C1C[C@]2(C)C3CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CCC2[C@](CO)(C)[C@@H]1O |
|
| MCULE-7929024326 |
0.67 |
C1(O)C(=O)C=C(C)C2(CCC(C(O)(CO)C)C2)C1C |
|
| MCULE-2350131012 |
0.67 |
C(CCCCCCCCC=CCCCCCC)(OC)=O |
|
| MCULE-2817082882 |
0.67 |
C1C[C@]2(C)[C@@]([H])(CC/C(/C)=C/CO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1 |
|
| MCULE-3684696083 |
0.67 |
CCCCCC/C=C/CCCCCCCC(OC)=O |
|
| MCULE-6674544067 |
0.67 |
OC(C1(CC=CC1)CC1CC(F)(F)C1)=O |
|
| MCULE-3213163274 |
0.67 |
COC1C(C2(C(O)=O)CC=CC2)CCC1 |
|
| MCULE-6262778979 |
0.67 |
OC1(C(CC2CC=CC2)=O)CCCCC1 |
|
| MCULE-4737898468 |
0.67 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C=1C(C2)=O |
|
| MCULE-4563413881 |
0.67 |
CC(C(O)=O)(CC1CCCCC=1)N.Cl |
|
| MCULE-6267867370 |
0.67 |
C12(C(C)(C)C)C=CC1(C(=O)C2(C)O)C(C)(C)C |
|
| MCULE-9909477927 |
0.67 |
OC(CC1CCCCC=1)=O |
|
| MCULE-2797527002 |
0.67 |
C1(C(=O)O)=CCC(CCCCCC)CC1 |
|
| MCULE-4900399116 |
0.67 |
C1CC2C(=O)C3CC=CCC3C(=O)C2CC=1 |
|
| MCULE-4453341269 |
0.67 |
O=C1C2CC(C)=C(C)CC2C(C2CC(C)=C(C)CC21)=O |
|
| MCULE-1789440443 |
0.67 |
O=C(O)C1C(N)C2CCC1C=C2 |
|
| MCULE-6900103591 |
0.67 |
C1CC2(C)C3C=CC4=C(C(CC(O)C(O)C(O)(C)C)C)C(=O)CC4(C)C3(C)CCC2C(C)(C)C1=O |
|
| MCULE-4665716653 |
0.67 |
N(CC)(CC)CC.C12(C)CCC(O)CC1=CCC1C2CCC2(C)C(CCC21)(O)CCC(O)=O |
|
| MCULE-6767000432 |
0.67 |
C1CCC(C(O)=O)CCC=1 |
|
| MCULE-9031983714 |
0.67 |
C1=CC2C3C(C)=C(C)C3C1C(C(OC)=O)C2C(OC)=O |
|
| MCULE-8186617947 |
0.67 |
C1=CC2C3C=C(C)C3C1C(C(OC)=O)C2C(OC)=O |
|
| MCULE-8651982947 |
0.67 |
C(C)(C1(O)C(=C)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O |
|
| MCULE-8140747078 |
0.67 |
C(CCCCCCCC=CCCCCCCCC)(OC)=O |
|
| MCULE-9857200349 |
0.67 |
C1(CCC(CC=1)C(C)(C)C)C(O)=O |
|
| MCULE-7230877379 |
0.67 |
O=C1CCC(C2CC=CCC21)=O |
|
| MCULE-2237684707 |
0.67 |
C12(CC(C(=O)C(C)=C1CC)C)C(=O)CCC2C(O)=O |
|
| MCULE-1052417281 |
0.67 |
C(CCCCCCCCCCCCCC=CCCCCCCCC)(OC)=O |
|
| MCULE-4113416417 |
0.67 |
[C@]12(C)C[C@H](O)C3[C@@]([H])(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(O)=O |
|
| MCULE-2979260832 |
0.67 |
C1CC2(CO)CCCC2(CO)CC=1 |
|
| MCULE-4207554768 |
0.67 |
C12C=CC(C(C(OC)=O)C1C(OC)=O)C1C=CC21 |
|
| MCULE-9513706661 |
0.67 |
C1CC2(C(CCC(C2CC/C(=C\CO)/C)=C)C(C1)(C(=O)O)C)C |
|
| MCULE-6541953240 |
0.67 |
C1CCC(C(C)(C(O)=O)C)=CCCC1 |
|
| MCULE-8493572612 |
0.67 |
C([H])(CCCCCCCC)=C(CCCCCCCCCCCC(=O)OC)[H] |
|
| MCULE-2422100047 |
0.67 |
C1(C/C=C/CC)=C(CCC1=O)CCCCCCCC(=O)O |
|
| MCULE-6424725551 |
0.67 |
C1C[C@@](C2CC[C@](C)([C@@H]([C@@]2(C)C1)CC/C(/C)=C\CO)O)(C(O)=O)C |
|
| MCULE-7323379876 |
0.67 |
C1C2(CO)CCC2(CO)CC=C1 |
|
| MCULE-2959266522 |
0.67 |
CCCCCCCC(O)/C=C\C(CCC(O)CCCC(=O)O)O |
|
| MCULE-1323295889 |
0.67 |
C1C[C@@H](C(C(O)=O)=C)C[C@@]2([H])C(O)(CC[C@@]3([H])[C@]4([H])C[C@H](C(=C)C(=O)O)CC[C@@]4(C)C=CC3=O)C(=O)C=C[C@@]21C |
|
| MCULE-6601187734 |
0.67 |
C1CC23CCC(=O)C2(CCCC3)CC=1 |
|
| MCULE-9554247289 |
0.67 |
C1CC2(CO)CC(C)(C)CC2(CO)CC=1 |
|
| MCULE-6136215019 |
0.67 |
C1=CC2CC1C(C(=O)OC)C2C(=O)OC |
|
| MCULE-8045534685 |
0.67 |
C(O)(C(CC)C1CCCCC=1)=O |
|
| MCULE-3401105479 |
0.67 |
C1CC2(C(=O)O)C3(O)CCC(C)(C=C)C=C3C(=O)CC2C(C)(C)C1 |
|
| MolPort-000-424-825 |
0.67 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(Br)ccc2o1 |
|
| MolPort-035-946-516 |
0.67 |
CC(C)COc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-023-302-873 |
0.67 |
O=C(Oc1ccc2c(c1)oc(-c1ccccc1)c(OC(=O)c1ccccc1)c2=O)c1ccccc1 |
|
| MolPort-035-946-516 |
0.67 |
CC(C)COc1ccc(cc1)-c1oc2ccccc2c(=O)c1O |
|
| MolPort-039-013-993 |
0.67 |
Oc1ccc(c(O)c1O)-c1cc(=O)c2ccccc2o1 |
|
| MolPort-044-559-814 |
0.67 |
Oc1cc(O)c2cc(O)c([o+]c2c1)-c1ccc(O)c(O)c1 |
|
| MolPort-002-519-727 |
0.67 |
COc1cc(cc(I)c1OC)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-000-587-971 |
0.67 |
COc1ccc(cc1)-c1oc2ccc(C)cc2c(=O)c1OCC(O)=O |
|
| MolPort-000-659-817 |
0.67 |
COc1cc(O)c2c(c1)oc(cc2=O)-c1ccccc1 |
|
| MolPort-000-670-208 |
0.67 |
COc1ccc(c(OC)c1)-c1cc(=O)c2cc(C)ccc2o1 |
|
| MolPort-006-115-081 |
0.67 |
COc1ccc(cc1)-c1cc(=O)c2c(O)c(C)c(OC)c(C)c2o1 |
|
| MolPort-000-675-865 |
0.67 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(=O)CCc1ccccc1 |
|
| MolPort-023-302-873 |
0.67 |
O=C(Oc1ccc2c(c1)oc(-c1ccccc1)c(OC(=O)c1ccccc1)c2=O)c1ccccc1 |
|
| MolPort-000-479-697 |
0.67 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(Cl)cc(Cl)c2o1 |
|
| MolPort-000-674-958 |
0.67 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(C)cc(C)c2o1 |
|
| MolPort-000-424-823 |
0.67 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(Cl)ccc2o1 |
|
| MolPort-019-937-145 |
0.66 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 |
|
| MolPort-003-932-836 |
0.66 |
[Cl-].Oc1cc(O)c2cc(O)c([o+]c2c1)-c1cc(O)c(O)c(O)c1 |
|
| MolPort-028-610-062 |
0.66 |
COc1cc(ccc1O)-c1oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-021-802-750 |
0.66 |
CCc1ccc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1 |
|
| MolPort-046-763-881 |
0.66 |
COc1ccc(cc1OC(=O)c1ccccc1)-c1cc(=O)c2c(OC(=O)c3ccccc3)cc(OC(=O)c3ccccc3)cc2o1 |
|
| MolPort-035-705-968 |
0.66 |
COc1c(C)c(O)c2c(oc(cc2=O)-c2ccc(O)cc2)c1C |
|
| MolPort-003-939-101 |
0.66 |
[Cl-].Oc1cc(O)c2cc(O)c([o+]c2c1)-c1ccc(O)c(O)c1 |
|
| MolPort-002-834-826 |
0.66 |
CC(C)Oc1ccc(cc1)-c1cc(=O)c2c(OC(C)C)cc(OC(C)C)cc2o1 |
|
| MolPort-002-894-048 |
0.66 |
COc1ccc2c(c1)oc(cc2=O)-c1ccccc1OC |
|
| MolPort-000-695-871 |
0.66 |
CCOc1cc(ccc1O)-c1cc(=O)c2cc(C)ccc2o1 |
|
| MolPort-001-524-670 |
0.66 |
COc1ccccc1-c1oc2ccccc2c(=O)c1O |
|
| MolPort-000-424-824 |
0.66 |
COc1ccc(cc1OC)-c1cc(=O)c2cc(F)ccc2o1 |
|
| MolPort-021-802-750 |
0.66 |
CCc1ccc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1 |
|
| MolPort-000-676-418 |
0.66 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccc(F)cc1 |
|
| MolPort-000-671-065 |
0.66 |
COc1cc(cc(OC)c1OC)C(=O)Oc1ccc2oc(cc(=O)c2c1)-c1cc(OC)c(OC)c(OC)c1 |
|
| MolPort-000-676-314 |
0.66 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OCc3ccc(Cl)cc3Cl)ccc2o1 |
|
| MolPort-046-763-881 |
0.66 |
COc1ccc(cc1OC(=O)c1ccccc1)-c1cc(=O)c2c(OC(=O)c3ccccc3)cc(OC(=O)c3ccccc3)cc2o1 |
|
| MolPort-008-821-911 |
0.66 |
COc1ccc2c(c1)oc(-c1ccc(cc1)C(O)=O)c(O)c2=O |
|
| MolPort-046-792-728 |
0.66 |
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1ccccc1Br |
|
| MolPort-035-946-517 |
0.66 |
Oc1c(oc2ccccc2c1=O)-c1ccc(OC(F)F)cc1 |
|
| MolPort-000-675-855 |
0.66 |
COC(=O)Oc1c(oc2ccccc2c1=O)-c1ccc(OC)cc1 |
|
| MolPort-001-834-835 |
0.66 |
O=c1cc(oc2ccccc12)-c1ccc2OCCOc2c1 |
|
| MolPort-002-508-988 |
0.66 |
O=c1cc(oc2c3ccccc3ccc12)-c1ccc2OCCOc2c1 |
|
| MolPort-002-270-082 |
0.66 |
Oc1c(oc2ccccc2c1=O)-c1ccc(OCc2ccccc2)cc1 |
|
| MolPort-035-946-517 |
0.66 |
Oc1c(oc2ccccc2c1=O)-c1ccc(OC(F)F)cc1 |
|
| MolPort-008-818-988 |
0.66 |
COc1cc(ccc1O)-c1cc(=O)c2cc(Br)ccc2o1 |
|
| MolPort-000-675-860 |
0.66 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OC(=O)c1ccc(Cl)cc1Cl |
|
| MolPort-046-764-921 |
0.66 |
[Cl-].COc1cc(OC(=O)c2ccccc2)c2cc(O)c([o+]c2c1)-c1cc(OC)c(OC(=O)c2ccccc2)c(OC)c1 |
|
| MolPort-000-675-866 |
0.66 |
O=c1c(OCC#N)c(oc2ccccc12)-c1ccccc1 |
|
| MolPort-002-521-098 |
0.66 |
COc1cc(cc(I)c1O)-c1cc(=O)c2cc(O)ccc2o1 |
|
| MolPort-008-819-807 |
0.66 |
COc1ccc2oc(-c3ccc(cc3)C(O)=O)c(O)c(=O)c2c1 |
|
| MolPort-000-695-885 |
0.66 |
COc1ccccc1-c1oc2ccc(C)cc2c(=O)c1O |
|
| MolPort-008-825-740 |
0.66 |
CCc1ccc2oc(-c3ccc(OC)cc3)c(O)c(=O)c2c1 |
|
| MolPort-000-599-475 |
0.66 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1Oc1nc(C)cc(C)n1 |
|
| MolPort-000-606-852 |
0.66 |
COc1ccc(cc1OC)-c1oc2ccc(Cl)cc2c(=O)c1OC(=O)OCC(C)C |
|
| MolPort-000-676-417 |
0.66 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCc1ccccc1Cl |
|
| MolPort-046-764-921 |
0.66 |
[Cl-].COc1cc(OC(=O)c2ccccc2)c2cc(O)c([o+]c2c1)-c1cc(OC)c(OC(=O)c2ccccc2)c(OC)c1 |
|
| MolPort-035-705-968 |
0.66 |
COc1c(C)c(O)c2c(oc(cc2=O)-c2ccc(O)cc2)c1C |
|
| MolPort-000-678-409 |
0.66 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2c(CN(C)Cc3ccccc3)c(O)ccc2o1 |
|
| MolPort-046-792-728 |
0.66 |
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1ccccc1Br |
|
| MolPort-000-676-299 |
0.66 |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2cc(OC(=O)c3ccc(cc3)C(C)(C)C)ccc2o1 |
|
| MolPort-000-676-416 |
0.66 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OC(C)C(O)=O |
|
| MolPort-000-123-910 |
0.66 |
COc1ccc(cc1OC)-c1oc2ccccc2c(=O)c1OCC(=O)N1CCCC1 |
|
| MolPort-019-937-145 |
0.66 |
COc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 |
|
| MolPort-028-610-062 |
0.66 |
COc1cc(ccc1O)-c1oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c(O)c2c(=O)c1OC |
|
| MolPort-003-665-809 |
0.66 |
Oc1ccc2c(oc(cc2=O)-c2ccccc2)c1O |
|
| MolPort-005-945-364 |
0.66 |
COc1c(O)ccc2oc(cc(=O)c12)-c1ccccc1 |
|
| MolPort-003-757-487 |
0.66 |
COc1cc(O)cc2oc(cc(=O)c12)-c1ccccc1 |
|
| MolPort-000-718-794 |
0.66 |
O=c1cc(oc2ccccc12)-c1ccc2OCOc2c1 |
|
| MolPort-000-123-867 |
0.66 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC(C)=O |
|
| MCULE-8152778304 |
0.66 |
C1(CO)(CO)CCC(=CC1)C |
|
| MCULE-9798755896 |
0.66 |
C1CC(CCC=1C)C(C)(C)O |
|
| MCULE-3331110138 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@H](C)C(C)C)C)CC[C@@]4([H])C3=CC(=O)[C@@]2(O)C[C@H]1O |
|
| MCULE-1536375497 |
0.66 |
CC1(C(CC2CCCC=2)CCCC1)O |
|
| MCULE-2390783905 |
0.66 |
[C@]12(C)[C@H](O)CC3[C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1[C@H](C[C@@H]2C(C)=O)O |
|
| MCULE-7790352459 |
0.66 |
C[C@@]1([C@H](CC2CCCC=2)CCCC1)O |
|
| MCULE-4834546197 |
0.66 |
C1=C(C)CCC(C=O)C1C |
|
| MCULE-6735391183 |
0.66 |
C12C(C)(C)CCCC=1CC(C)C(C=O)C2 |
|
| MCULE-7022735372 |
0.66 |
C1(=O)CC2C(C)(CCC(CC(O)=O)C)C(C)CCC2(C)C(C(O)=O)=C1 |
|
| MCULE-9761993676 |
0.66 |
C1=C(C)CC([C@@H](C=O)C1C)C |
|
| MCULE-7846055076 |
0.66 |
C1C[C@@]([H])(CCC=1C)[C@@](C)(CC/C=C(/C)\C)O |
|
| MCULE-9174314602 |
0.66 |
C1C[C@H](CCC=1C)[C@](C)(CC/C=C(\C)/C)O |
|
| MCULE-8948864854 |
0.66 |
C(O)(C)(C)[C@H]1CC=C(C)CC1 |
|
| MCULE-4617598220 |
0.66 |
CC(C1(C(O)=O)CC2(CCC2)C1)C=C |
|
| MCULE-2496032129 |
0.66 |
OC(C1(CC=CC1)CC1CCOCC1)=O |
|
| MCULE-6184897823 |
0.66 |
C(O)(C)(C)[C@@H]1CC=C(C)CC1 |
|
| MCULE-6347280691 |
0.66 |
OC(C1(CC=CC1)CC1(C#N)CC1)=O |
|
| MCULE-6567295142 |
0.66 |
C1=CC2C3C4C5C6(C(O)CC5C5CC(O)C26C54)C13 |
|
| MCULE-3149377803 |
0.66 |
C1CC(CCC=1C)C(C)=O |
|
| MCULE-4494327817 |
0.66 |
C1(=O)C=CC2(C)C3C(O)CC4(C)C(O)(C(=O)CO)C(C)CC4C3CCC2=C1 |
|
| MCULE-6240066964 |
0.66 |
C1C(C)=CC[C@H](C(O)(C)C)C1 |
|
| MCULE-9381861258 |
0.66 |
C1(O)CC2C(C)(CCC(CC(O)=O)C)C(C)CCC2(C)C(C(O)=O)=C1 |
|
| MCULE-6086039312 |
0.66 |
O=C1C2(O)C(C)(CCC(O)C2)C2(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C2=C1)[H] |
|
| MCULE-5376882383 |
0.66 |
C[C@@H]1C2=CC(C=C[C@]2(C)[C@@H]2[C@H]([C@H]3[C@](C)(C[C@@H]2O)[C@@](O)(C(CO)=O)CC3)C1)=O |
|
| MCULE-5733786329 |
0.66 |
C(C(=O)O)C[C@]1(C)C2=CC[C@]3(C)[C@@]([H])([C@H](C(=O)O)CC/C=C(/C)\C)[C@H](O)C[C@@]3(C)C2=CC[C@@]1([H])C(=C)C |
|
| MCULE-2663447615 |
0.66 |
CC1(C(F)(F)C1)CC1(C(O)=O)CC=CC1 |
|
| MCULE-5339139192 |
0.66 |
[C@@]1(C(C)=C)([H])CC=C2[C@]3(C)C[C@@H](O)[C@H]([C@@H](CCC(=C)C(C)C)C(O)=O)[C@@]3(C)CC=C2[C@]1(CCC(=O)O)C |
|
| MCULE-1183560917 |
0.66 |
C1(=O)C[C@@]2([C@]([H])(C/C/1=C(\C)/C)[C@@]2([H])CC[C@H](O)C)C |
|
| MCULE-2137893098 |
0.66 |
C12C(C)(C)CCCC=1CC(C)C(C)(C(C)=O)C2 |
|
| MCULE-2907287296 |
0.66 |
C1C(CC2C1(C(C(C(=O)O)=C2)CC(O)=O)C(=O)C)(C)C |
|
| MCULE-3433336466 |
0.66 |
C1=C(C)CC(C(C=O)C1C)C |
|
| MCULE-8934838036 |
0.66 |
C12(C)C=CC(C=C1[C@H](CC1C3C(C)([C@@](CC3)(O)C(CO)=O)CC(O)C21)C)=O |
|
| MCULE-1327121373 |
0.66 |
CC(CC1(C(O)=O)CC2(CCC2)C1)=C |
|
| MCULE-7053911643 |
0.66 |
C(O)(=O)CC1C(CC=CC)CC(C1)=O |
|
| MCULE-4436654330 |
0.66 |
C1=CC2C3CC3C1C(CO)C2CO |
|
| MCULE-9310117393 |
0.66 |
C1CC2(C)C3CCC(C)(C=C)C=C3C(O)CC2C(C(=O)O)(C)C1 |
|
| MCULE-8414811975 |
0.66 |
CC(C)([C@H]1CCC(C)=CC1)O |
|
| MCULE-6709791224 |
0.66 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(=O)O)=C)CC(O)C4(C)C=3CCC2C(C)(C)C1=O |
|
| MCULE-7633282937 |
0.66 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)C)C)CC(O)C4(C)C3=CCC2C(C)(C)C1=O |
|
| MCULE-2832089707 |
0.66 |
C1CC2(C)C3=CC(=O)C(C)(C=C)CC3CCC2C(C(=O)O)(C)C1 |
|
| MCULE-3206249578 |
0.66 |
C1CC(CCC=1C)C(C)(CC/C=C(\C)/C)O |
|
| MCULE-4729152230 |
0.66 |
C12CCC(C(C)CCCC(C)C)C1(C)CCC1=C3CCC(O)CC3(C(O)CC21)C |
|
| MCULE-5764697777 |
0.66 |
C1=CC2(C)C3C(C4CCC(O)(C(=O)CO)C4(CC3O)C)CC(C)C2=CC1=O |
|
| MCULE-8621711737 |
0.66 |
C12([H])CCC=CCCC1(C2C(OC)=O)[H] |
|
| MCULE-5486459234 |
0.66 |
OC(C1(CC2(CCC2)C1)CC=C)=O |
|
| MCULE-6862768146 |
0.66 |
OC(C1(CC=CC1)CC1C(F)(F)C1)=O |
|
| MCULE-2870645391 |
0.66 |
C12(C3C4C5C1C=CC5C2(CO)C4C=C3)CO |
|
| MCULE-2672801418 |
0.66 |
C1(C)(CC=CC1(C)C)C(O)=O |
|
| MCULE-6519818800 |
0.66 |
[C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])[C@]3([C@@](C)([C@@](CC3)(O)C(CO)=O)C[C@H](O)[C@]21[H])[H])C)=O |
|
| MCULE-6436563816 |
0.66 |
C(CCCCCC)CC1CC=1CCCCCCCC(=O)OC |
|
| MCULE-3157582211 |
0.66 |
OC(C1(C2C(C#N)CCC2)CC=CC1)=O |
|
| MCULE-3531952070 |
0.66 |
C1CC2(C)C3CCC4(C)C(C(C(=O)/C=C(\C)/C(O)(C)C)C)CCC4C=3CCC2(O)C(C)(C)C1O |
|
| MCULE-2989209658 |
0.66 |
C1(CO)(CO)CC=C(CC1C)C |
|
| MCULE-4506773274 |
0.65 |
C/C(/C)=C/C1C(C)(C)C1C(O)=O |
|
| MCULE-1739570677 |
0.65 |
[C@@]12([H])CC[C@@](O)(C)[C@@]1([H])C/C(=C(/C)\C)/C(=O)C[C@]2(O)C |
|
| MCULE-6309054443 |
0.65 |
C1=CC2C1C(C(OC)=O)C2C(OC)=O |
|
| MCULE-7089035597 |
0.65 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(C)CCC(C)C(C)C21[H])[H] |
|
| MCULE-4168657248 |
0.65 |
[C@H]1(CCC(=O)CCCCCCC)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)OC(C)C |
|
| MCULE-7610148262 |
0.65 |
C1C(C(=O)O)(C)C=CCC1 |
|
| MCULE-3836274754 |
0.65 |
C12CC(C=C1)C(CO)(CO)C2 |
|
| MCULE-7933835085 |
0.65 |
[C@@]12(C)[C@](O)(CCC1C1C(C(O)C2)[C@@]2(C)CCC(C=C2CC1)=O)C#N |
|
| MCULE-3788851533 |
0.65 |
[C@]12(C)CCC[C@@](C)(C(O)=O)C1CCC1=CC(C(C)C)=CCC12 |
|
| MCULE-6020138869 |
0.65 |
C1C2CC(CC2C(=O)OC(C)(C)C)C=1 |
|
| MCULE-7240141445 |
0.65 |
[C@@]12([H])CC[C@H]([C@H](C)CCC(=O)OC)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H] |
|
| MCULE-4713145304 |
0.65 |
C1C[C@]2(C)[C@@]([H])(CC[C@@H](C)CCO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1 |
|
| MCULE-7341595899 |
0.65 |
C1(CO)(CO)CC=C(CC1C)CC/C=C(\C)/C |
|
| MCULE-7617211001 |
0.65 |
[C@H]1(C(=O)O)C([C@@H]1/C=C(\C)/C)(C)C |
|
| MCULE-9060371972 |
0.65 |
C12CC[C@H](O)[C@@]1(C)CCC(=O)C=2 |
|
| MCULE-7704943892 |
0.65 |
C1(CC)CC(=O)CCCCC=C1 |
|
| MCULE-3556948980 |
0.65 |
C1C[C@]2(C)[C@@]([H])(C/C=C(\C)/C=C)C(=C)CC[C@@]2([H])[C@](C(O)=O)(C)C1 |
|
| MCULE-6095158575 |
0.65 |
C1=C(C(C)C)[C@@]2([H])[C@H]3C(C(C)C)=C[C@H]([C@@](C)(O)C3=O)[C@@]2([H])[C@@](C)(O)C1=O |
|
| MCULE-3633249572 |
0.65 |
C1CC23CC(C(OC)=O)C(=O)C2(CC=CC3)CC=1 |
|
| MCULE-6354515204 |
0.65 |
C1C[C@]2(C)[C@@]([H])(C/C=C(\C)/C=O)C(=C)CC[C@@]2([H])[C@@](C(O)=O)(C)C1 |
|
| MCULE-6334133550 |
0.65 |
C1CC([H])(CC(OC)=O)C([H])(CC(OC)=O)CC=1 |
|
| MCULE-3069989292 |
0.65 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C=O)C1CC[C@]2([H])[C@H](C)CCCC(C)C |
|
| MCULE-6144873686 |
0.65 |
C12=CC(=O)[C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)C(CC[C@@]21O)=O |
|
| MCULE-4463064740 |
0.65 |
C(OCC)(C1CC2CC1C=C2)=O |
|
| MCULE-6355846723 |
0.65 |
C1CC2=CC(=O)/C(/C[C@]2(C)[C@H]([C@@H]1O)C)=C(\C)/C |
|
| MCULE-9123998949 |
0.65 |
C1CC(CC(OC)=O)(C)C(CC(OC)=O)(C)CC=1 |
|
| MCULE-3161766037 |
0.65 |
C(O)(C1=CCCCCCCCCC1)=O |
|
| MCULE-2814899152 |
0.65 |
O=CC1(CCCCC1)CC1CC=CCC1 |
|
| MCULE-7399965638 |
0.65 |
CCC/C=C/C=C/C(CC(O)=O)CCC(=O)O |
|
| MCULE-4484854858 |
0.65 |
OC(C1(CC=CCC1)CC#N)=O |
|
| MCULE-6879064173 |
0.65 |
C12C[C@@H](CC[C@H](C)[C@]1([H])CC(=O)C=2C)C(=C)C(O)=O |
|
| MCULE-5060620930 |
0.65 |
CC(C=O)(CC1C2C=CC(CC2)C1)C |
|
| MCULE-4852376400 |
0.65 |
O=CCCC1C2C=CC(CC2)C1 |
|
| MCULE-7420090326 |
0.65 |
C1(C(C)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C |
|
| MCULE-6934036262 |
0.65 |
C1(C(CCCC(C2C(=O)CC(CC2=O)(C)C)C2C(=O)CC(CC=2O)(C)C)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C |
|
| MCULE-3272252898 |
0.65 |
O=C1CCC2(CO)C3CCC4(C)C(CCC4(C3CCC2=C1)[H])C(O)=O |
|
| MCULE-6336425947 |
0.65 |
C1(=O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@H]1O)(C)[C@@](O)(C(=O)CO)[C@@H](O)C3)CC2 |
|
| MCULE-3247130765 |
0.65 |
OC1CC(CC2CC=CCC2)CCC1 |
|
| MCULE-2960240255 |
0.65 |
O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)C4=CC[C@@]5(C)CCC(C)(C)C[C@H]5[C@]4(C)CC[C@H]23)C1(C)C |
|
| MCULE-1097149426 |
0.65 |
OC1C(CC2CC=CCC2)CCCC1 |
|
| MCULE-3556525470 |
0.65 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CC(C)=C2C(C)=O |
|
| MCULE-9151137367 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(CCC4(O)C3CCC2=C1)C(C)=O |
|
| MCULE-3987885076 |
0.65 |
C12=CC[C@]3([C@@H](CC[C@]3(O)C(CO)=O)[C@]1([H])CCC1=CC(=O)CC[C@]21C)C |
|
| MCULE-3588534045 |
0.65 |
C12(C)CCCC(C)(C(O)=O)C1CCC1=CC(C(C)C)=CCC12 |
|
| MCULE-2766753223 |
0.65 |
C(=O)(OC(C)C)C1CC2CC1C=C2 |
|
| MCULE-4789514903 |
0.65 |
CC(C1(C(O)=O)CC=CCC1)C#N |
|
| MCULE-8330160340 |
0.65 |
[C@@]12(C)CCC[C@@](C)(C(O)=O)[C@@]1([H])CCC(=C)[C@H]2CCC(C)CCO |
|
| MCULE-5606035595 |
0.65 |
C1(O)(C)C2CCC(O)(C)C2C/C(=C(\C)/C)/C(=O)C1 |
|
| MCULE-3077397941 |
0.65 |
C1(C(CCCC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C |
|
| MCULE-8322667113 |
0.65 |
C1(C(CC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C |
|
| MCULE-1643283288 |
0.65 |
C1(C(=O)CC(CC=1O)(C)C)C(C(C)C)C1C(=O)CC(CC1=O)(C)C |
|
| MCULE-2582951504 |
0.65 |
C1CC2(C)C(C(O)=O)=CCC2C(C)(C)C1 |
|
| MCULE-1563230915 |
0.65 |
OCC([C@]1([C@@](C[C@@]2([C@@]1(C[C@@]([C@]1([C@]2(CCC2=CC(C=C[C@]12C)=O)[H])[H])(O)[H])C)[H])(O)[H])O)=O |
|
| MCULE-7375184421 |
0.65 |
C/C(/C)=C/[C@]1([C@@](C(O)=O)(C1(C)C)[H])[H] |
|
| MCULE-5480996294 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(O)(CCC4C3CC(O)C2=C1)C(CO)=O |
|
| MCULE-2122796304 |
0.65 |
C(O)(C12CCC(O)CC1(O)CCC1C3=CCC(C3(C)CCC21)C(OCC)=O)=O |
|
| MCULE-8494008475 |
0.65 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C(=O)O)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1=O |
|
| MCULE-5845924187 |
0.65 |
OCCC1(C(O)=O)CC=CC1 |
|
| MCULE-3830868177 |
0.65 |
CC1CC(CC2CC=CCC2)C(=O)CC1 |
|
| MCULE-4114109251 |
0.65 |
C12C3C4C5C3C1C(C(=O)O)=C(C(=O)O)C5C24 |
|
| MCULE-6498196947 |
0.65 |
C12C=CC1C1CC(O)C12 |
|
| MCULE-2479536906 |
0.65 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(OC)=O)[H] |
|
| MCULE-7903507006 |
0.65 |
C1(C(CCC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C |
|
| MCULE-6649773698 |
0.65 |
C1CC2(C(CCC(C2CC/C(=C\CO)/CO)=C)C(C(O)=O)(C)C1)C |
|
| MCULE-2936092419 |
0.65 |
CC(C(C)=O)CC1C2C=CC(CC2)C1 |
|
| MolPort-000-676-393 |
0.65 |
Cc1ccc(OCCCOc2c(oc3ccccc3c2=O)-c2ccc(C)cc2)cc1 |
|
| MCULE-6531167311 |
0.65 |
CC(CCC1C2C=CC(CC2)C1)=O |
|
| MolPort-046-590-413 |
0.65 |
COc1ccc(cc1)-c1cc(=O)c2c(OC)cc(OCc3ccccc3)cc2o1 |
|
| MCULE-2247897001 |
0.65 |
COC(C1C2(C)C(C3C(CC2)C2(C)C(CC(CC2)O)=CC3)CC1)=O |
|
| MolPort-002-510-401 |
0.65 |
Oc1c2OCCOc2cc2oc(cc(=O)c12)-c1ccccc1 |
|
| MCULE-8944178238 |
0.65 |
CCCCCCCCC(C(/C=C\C(O)CCCCC(O)=O)O)O |
|
| MolPort-028-610-061 |
0.65 |
COc1ccc(cc1O)-c1oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c(O)c2c(=O)c1OC |
|
| MCULE-7887886977 |
0.65 |
CC(C1(C(O)=O)CC=CC1)CO |
|
| MolPort-008-821-909 |
0.65 |
COc1cc(ccc1O)-c1cc(=O)c2ccc(C)c(C)c2o1 |
|
| MCULE-1556522580 |
0.65 |
C1(=O)CCC=CCCCCC1 |
|
| MolPort-001-537-048 |
0.65 |
Oc1c(oc2ccccc2c1=O)-c1ccc(F)c(Oc2ccccc2)c1 |
|
| MCULE-7321817046 |
0.65 |
CC1([C@@]2(CCC(C(=O)O)=CC2)C(=C)CCC1)C |
|
| MolPort-000-676-387 |
0.65 |
COC(=O)c1ccc(COc2c(oc3ccccc3c2=O)-c2ccc(C)cc2)cc1 |
|
| MCULE-8805854090 |
0.65 |
[C@]12(C)CCC3C(CC=C4CC(O)CC[C@]34C)C1CCC2C(C)CCC(OC)=O |
|
| MolPort-000-123-868 |
0.65 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OC(C)C(C)=O |
|
| MCULE-1844358842 |
0.65 |
[C@H]1(O)C[C@@]2(C3CC[C@]4([C@](CCC4[C@](O)(C)[C@H](O)C[C@](O)(C)C(C)C)(O)C3=CC(C2C[C@H]1O)=O)C)C |
|
| MolPort-000-584-142 |
0.65 |
CCOC(=O)COc1c(oc2ccccc2c1=O)-c1ccc(OC)cc1 |
|
| MCULE-4576776987 |
0.65 |
C1(C2C3C4CC4(C4CCC(=C4CC3(CO)CCC2(C(C1)O)C)C(O)=O)C)C(C)C |
|
| MolPort-008-818-980 |
0.65 |
CCc1ccc2oc(cc(=O)c2c1)-c1ccc(O)c(OC)c1 |
|
| MCULE-6950544067 |
0.65 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCC(OC)=O)[H] |
|
| MolPort-000-606-748 |
0.65 |
COc1ccc(cc1)-c1oc2ccc(Cl)cc2c(=O)c1O |
|
| MCULE-7110535304 |
0.65 |
C(O)(C)(CC(O)CC(O)(C)C)C1C2(C(C3C(C4(C(CC(C(C4)O)O)C(=O)C=3)C)CC2)(O)CC1)C |
|
| MolPort-000-676-452 |
0.65 |
COc1c(oc2ccccc2c1=O)-c1ccccc1Cl |
|
| MCULE-1741751705 |
0.65 |
C[C@]12[C@@]3(CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC=C1[C@H]1[C@H](CCC(C1)(C)C)CC2)C |
|
| MolPort-000-676-388 |
0.65 |
Cc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC#N |
|
| MCULE-4046520863 |
0.65 |
[C@@H]1(C[C@@]2(C3CC[C@]4([C@@](CC[C@@H]4[C@@]([C@H](O)CC(O)C(O)(C)C)(C)O)(C3=CC([C@]2([H])C[C@H]1O)=O)O)C)C)O |
|
| MolPort-002-508-556 |
0.65 |
Cc1ccc2c(c1)oc(cc2=O)-c1ccc2OCCOc2c1 |
|
| MCULE-1470831787 |
0.65 |
C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1OC(=O)C |
|
| MolPort-000-676-412 |
0.65 |
COc1ccc(cc1)-c1oc2ccccc2c(=O)c1OCC(N)=O |
|
| MCULE-8147130899 |