SANC00936 Villenol




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-022-390-073 1 COc1cc(O)c(C(C)=O)c(OC)c1OC
MolPort-001-792-221 1 COc1cc(OC)c(cc1OC)C(C)=O
MolPort-022-390-073 1 COc1cc(O)c(C(C)=O)c(OC)c1OC
MolPort-001-768-703 0.97 COc1ccc(C(C)=O)c(OC)c1OC
MCULE-6114329924 0.97 [C@H]1(O)C[C@]2([H])[C@@](C)(CC[C@@](O)(C=C)C)[C@H](C)CC[C@@]2(C)C(C)=C1
MolPort-022-379-219 0.95 COc1cc(C(C)=O)c(OC)cc1O
MolPort-022-379-219 0.95 COc1cc(C(C)=O)c(OC)cc1O
MCULE-8984962328 0.94 [H]C12CC(O)C=CC1(C)C1CCC3(C)CCCC3C1CC2
MCULE-9945451158 0.94 [C@]12(C)C=CC(C[C@]1(C)CCC1C2CC[C@]2(C1CC[C@@H]2O)C)(C)O
MCULE-1025553559 0.94 C(C1=CCCC2(CCCCC2)C1)O
MolPort-001-537-601 0.93 COc1cc(O)c(cc1OC)C(C)=O
MolPort-003-803-644 0.92 COc1cc(O)c(C(C)=O)c(OC)c1O
MCULE-2216758301 0.91 C1(C)(C)C2([H])C(O)C=C(C)C1(C2)[H]
MCULE-7918435177 0.91 C1(C)(C)[C@]2([H])C[C@@]1([H])C(C)=C[C@@H]2O
MCULE-2011068282 0.91 C1(CO)C(C)(C)CCCC=1C
MCULE-4355376092 0.91 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])C[C@@H](O)C2=C[C@H]1O
MolPort-035-881-066 0.90 COc1ccc(cc1O)C(=O)c1cc(OC)c(OC)c(OC)c1OC
MolPort-001-762-019 0.90 COc1ccc(OC)c(C(C)=O)c1O
MolPort-000-881-059 0.90 COc1ccc(C(C)=O)c(O)c1OC
MolPort-035-881-066 0.90 COc1ccc(cc1O)C(=O)c1cc(OC)c(OC)c(OC)c1OC
MolPort-039-013-457 0.88 COc1cc(C(C)=O)c(O)cc1O
MolPort-001-004-322 0.88 CCC(=O)c1cc(OC)c(OC)cc1OC
MolPort-002-818-089 0.88 CCC(=O)c1c(O)c(OC)c(OC)cc1OC
MolPort-039-013-457 0.88 COc1cc(C(C)=O)c(O)cc1O
MCULE-6754513691 0.88 [C@]1([H])([C@@H](C)CC/C=C(\C)/C)[C@@H](O)C=C(C)[C@H](O)C1
MCULE-3033801776 0.88 OC(C12CCCC1C2)C1CCCCC=1
MCULE-3195811210 0.88 OC1(C=CCCC1)CC1CC=CC1
MCULE-4923642243 0.88 C1(CO)=C(C)CC2CC1C2(C)C
MCULE-8413416808 0.88 C/C(/C)=C/CCC1(C=CCCC1)O
MCULE-6718216216 0.88 CC1CC(CC/C=C(\C)/C)=CC(O)C1
MCULE-1110457062 0.88 OC(C1CCCCC=1)C1C(C2CC2)C1
MCULE-9641907119 0.88 C12C(C)(O)C=CC(C1)CC2
MCULE-8676658606 0.88 C1(O)CC2CC2C=C1
MCULE-9379929413 0.88 C1(O)CC2(C)CC2(C)C=C1
MCULE-7791473919 0.88 C(C1(CCCCC1)O)=CC1(CCCCC1)O
MCULE-1420218917 0.88 C(C)(=C)C1CCC(CO)=CC1
MCULE-6313856149 0.88 CC1CC(C(C2CCCCC=2)O)C1
MCULE-6022003482 0.88 [C@@H]1(O)C(C)=C[C@H](O)[C@@H](C(C)C)C1
MCULE-3817844296 0.88 OC/C=C(\C)/CC[C@@H]1[C@]2(C)[C@H](C(C)(C)CCC2)CC[C@@]1(C)O
MolPort-000-881-380 0.87 COc1cc(cc(OC)c1OC)C(C)=O
MCULE-8852979871 0.86 C1(C)(O)CC(CC=C1C)C(C)=C
MCULE-6129970627 0.86 C12C3C(C)C(C)C4C56CC(O)C=CC35C6C1C24
MCULE-7081887871 0.86 [C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](/C(/C)=C/CO)CC3)CC=2
MolPort-027-844-889 0.85 COc1cc(cc(O)c1OC)C(C)=O
MolPort-027-844-889 0.85 COc1cc(cc(O)c1OC)C(C)=O
MCULE-1747951282 0.85 C1CC23C=CC(O)([H])C2(CCCC3)CC1
MCULE-2204393281 0.85 C1C2CC2CCCC([H])(O)C=1
MCULE-6002311928 0.85 C[C@@H]([C@@H]1[C@]2(C)C(=C3[C@H](CC2)[C@]2(C)[C@H](C([C@@H](O)CC2)=C)CC3)CC1)CC[C@H](C(C)C)C
MCULE-8711501793 0.84 CC1(C=CCCC1)O
MCULE-1387113476 0.84 C12CCC(O)C=C1CCCC2O
MCULE-5946438019 0.84 C[C@]12C3[C@@H]([C@@]4([C@@H](CC=3)C(C)(C)[C@H](O)CC4)C)CC[C@]1(C)[C@@H]1[C@@H](C)[C@H](C)CC[C@]1(C)CC2
MCULE-7023706443 0.84 C1C(O)C(C)(C)C2CC=CCC2(C)C1
MCULE-2038225383 0.84 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2[C@@H](O)[C@H]1O
MCULE-5667364535 0.84 C(C=CC(O)CCCCC)(C)(C)C
MCULE-9038016383 0.84 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
MCULE-8699525142 0.84 C1(CCCCC1O)=CC(C)C
MCULE-3710984096 0.84 C1CC2(C)C3CCC4(C)C(C(/C=C/C(C(O)C)C(C)C)C)CCC4C3C(O)C=C2CC1O
MCULE-5100609642 0.84 [C@]12(C)CC[C@@]3([C@@]([H])(CC(CC3)(C)C)[C@]1(C)CCC1[C@@]3(C(C(C)(C)[C@H](CC3)O)CCC2=1)C)C
MCULE-6029934866 0.84 CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C([C@@H]([C@H](CC2)O)O)=CC3)[H])([H])CC1)C)C
MCULE-9297462921 0.84 C12(C)CCC(O)C=C1CCCC2O
MolPort-008-513-046 0.83 COc1cccc(C(C)=O)c1OC
MolPort-001-759-184 0.83 COc1cc(cc(OC)c1O)C(C)=O
MolPort-009-754-040 0.83 COc1ccc(C(C)=O)c(O)c1O
MolPort-005-306-873 0.83 COc1cc(C=O)c(OC)c(OC)c1OC
MolPort-002-867-248 0.83 COc1cc(OC)c(C=O)c(OC)c1OC
MolPort-000-871-193 0.83 COc1cc(OC)c(C=O)cc1OC
MolPort-015-163-154 0.83 COc1cc(O)c(C=O)c(OC)c1OC
MolPort-039-338-472 0.83 COc1cc(O)cc(C(C)=O)c1O
MolPort-039-338-472 0.83 COc1cc(O)cc(C(C)=O)c1O
MCULE-1943700997 0.83 OC(C12CCCC1C2)C1CCCC=1
MCULE-9014720947 0.83 OC(C12CCCCC1C2)C1CCCC=1
MCULE-7610155056 0.83 C1CC2(C)C(CO)C(CO)=CCC2C(C)(C)C1
MCULE-3997698187 0.83 C1C[C@]23C[C@@]42CC[C@]2(C)[C@@]([H])([C@@H](C/C=C/C(O)(C)C)C)CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@H](C)[C@H]1O
MCULE-9808647935 0.82 [H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-1119605098 0.82 OC(C1CCCC=1)C1CC2(CCC2)C1
MCULE-6927409255 0.82 C12CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@]3(C)C=1CC[C@]1(C)[C@H](CC[C@@]21C)[C@H](C)CC/C=C(/C)\C
MCULE-6995939226 0.82 CC1CC(C(C2CCCCCC=2)O)C1
MCULE-6877512765 0.82 C12CC1C=CC([H])(O)C1CC12
MCULE-6275089676 0.82 CC(C1C(C(C2CCCC=2)O)C1)(C)C
MCULE-1784949358 0.82 OC(C1CCCC=1)C1C(C2CC2)C1
MCULE-2778793698 0.82 C12(C)CCC(C(C)CC/C=C(\C)/C)C1(C)CCC1C3C(C(C)(C)C(CC3)O)CCC2=1
MCULE-6020208251 0.82 O[C@@H]1C(C)(C)[C@@]2([H])[C@](C3CC[C@]4(C)[C@@](CC[C@H]4[C@H](C)CC/C=C(/C)\C)(C)C=3CC2)(C)CC1
MolPort-046-763-070 0.82 CCC(=O)c1c(O)c(O)c(OC)cc1OC
MolPort-006-827-290 0.82 COc1cc(C(C)=O)c(OC)c2OCOc12
MolPort-046-763-070 0.82 CCC(=O)c1c(O)c(O)c(OC)cc1OC
MolPort-000-872-019 0.82 COc1ccc(OC)c(c1)C(C)=O
MolPort-000-152-472 0.82 COc1ccc(C(=O)CBr)c(OC)c1OC
MCULE-6577726631 0.82 CC1([C@@]2([H])[C@](C3CC[C@@]4(C)[C@@](C)(CC[C@@H]4[C@@H](CCCC(C)C)C)C=3CC2)(C)CC[C@@H]1O)C
MCULE-5494176046 0.82 O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)CC4=CC[C@H]5C(C)(C)[C@@H](CC[C@]5(C)[C@H]4CC[C@H]23)O)C1(C)C
MCULE-3250846744 0.82 CC1CC(C(C2CCCC=2)O)C1
MCULE-8719465843 0.82 C12(C)CCC([H])(C(C)CC/C=C(\C)/C)C1(C)CCC1C3(C([H])(C(C)(C)C(CC3)O)CCC2=1)C
MCULE-5371316798 0.82 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[C@@]2([H])C[C@H]1O
MCULE-8519050416 0.82 C1=CC2CC1C1C(O)([H])C=CC12
MCULE-3774604452 0.82 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCC(=C)C(C)C)C)[C@@H](O)C[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
MCULE-5127489047 0.82 C12=CC[C@@]3([C@](C)(CC[C@H](O)[C@H]3C)C1CC[C@]1(C)[C@H](CCC12)[C@H](C)CCC(C(C)C)=CC)[H]
MCULE-5952812721 0.82 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)[C@@H](O)C[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
MCULE-6692951185 0.82 [C@@]12(C)CC[C@H]([C@H](C)CC/C=C(/C)\C)[C@@]1(C)CCC1[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CCC2=1)C
MCULE-6049121935 0.82 [H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)CCC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-3919531574 0.81 C1CC(CCC=1C)C(C)CO
MCULE-1804046736 0.81 O[C@@]1(CC[C@H](C(=C)C)C=C1)C
MCULE-5997570138 0.81 C(=CC(O)CC(C)C)CCCCCC
MCULE-3247130765 0.81 OC1CC(CC2CC=CCC2)CCC1
MCULE-2422158635 0.81 C1C[C@]2([H])[C@@](C)(CC/C(=C/CO)/C)[C@H](C)CC[C@@]2(C)C(C)=C1
MCULE-1097149426 0.81 OC1C(CC2CC=CCC2)CCCC1
MCULE-1679369036 0.81 [C@@]1(C)(O)CC[C@@H](C(C)=C)C=C1
MCULE-5285146625 0.81 C1C[C@@](C=C[C@@H]1C(=C)C)(O)C
MCULE-6689462252 0.81 OCCCC1C2C=CC(CC2)C1
MCULE-2960240255 0.81 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-8695225283 0.81 C1(C)(O)CCC(C(C)=C)C=C1
MCULE-7089035597 0.81 C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(C)CCC(C)C(C)C21[H])[H]
MCULE-3296869529 0.81 C=C(C)[C@H]1CC[C@](O)(C)C=C1
MolPort-003-802-600 0.81 CCC(=O)c1ccc(OC)c(OC)c1O
MCULE-9458964114 0.80 C/C(/C)=C/CCC1CCCCC(O)C=1
MolPort-001-762-282 0.80 COc1cc(O)c(C(C)=O)c(OC)c1
MolPort-000-871-220 0.80 COc1ccc(cc1OC)C(C)=O
MolPort-022-383-556 0.80 COc1ccc(C=O)c(C(C)C)c1OC
MolPort-000-871-950 0.80 COc1ccc(C(C)=O)c(OC)c1
MolPort-022-383-556 0.80 COc1ccc(C=O)c(C(C)C)c1OC
MolPort-015-162-531 0.80 COc1ccc(cc1O)C(=O)c1cc(OC)c(OC)c(OC)c1
MolPort-005-309-146 0.80 COc1c(O)c(O)cc(C=O)c1OC
MolPort-001-759-214 0.80 COc1cc(OC)c(C(C)=O)c(OC)c1
MolPort-000-871-192 0.80 COc1ccc(C=O)c(OC)c1OC
MCULE-2844730204 0.79 C12(C)CCC3C(CCC4CCCCC34C)C1C/C(=C(/C)\C)/C2O
MCULE-1095982134 0.79 [H]C12CC(O)CCC1(C)C1C=CC3(C)C(CCC3C(C)CCCO)C1CC2
MCULE-7081301004 0.79 OC[C@H]1[C@H]2C=C[C@H](CC2)C1
MCULE-5954084349 0.79 CC(C(CC1CC=CCC1)O)(O)C
MCULE-8650890619 0.79 CC1(C(C(CC2CC=CCC2)O)C1)C
MCULE-1038909539 0.79 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-3236832984 0.79 C12(C)C(C(C)CCCO)CCC1C1C(CC2)C2(CCCCC2C=C1)C
MCULE-5000750749 0.79 C1C2C3C(C4CC3C(O)C4)C(C2)C=1
MCULE-4780950529 0.79 [H]C12CCCC=C1CCC1C3CCC(O)C3(C)CCC21
MCULE-8295119802 0.79 C1C(O)(C2(O)CC(C)(C)CC(C)=C2)CC(C)(C)CC=1C
MolPort-016-635-513 0.79 CC(=O)c1cc2OCOc2cc1O
MolPort-027-910-708 0.79 COc1cc(C(C)=O)c(OC)cc1OCC#CC
MolPort-001-787-617 0.79 COc1ccc(C(C)=O)c(C)c1OC
MolPort-008-609-354 0.79 CCC(=O)c1cc(OC)c(OC)c(OC)c1
MolPort-003-991-334 0.79 O.COc1cc(cc(OC)c1OC)C(=O)C=O
MolPort-027-910-708 0.79 COc1cc(C(C)=O)c(OC)cc1OCC#CC
MolPort-005-945-874 0.79 COc1c(O)c(OC)c(C(=O)CCc2ccccc2)c(O)c1OC
MCULE-1091603091 0.78 C1=C(C)CC[C@@](C)(CCC(C)O)C1C
MCULE-4080553011 0.78 C12([H])CCC1([H])C=CC2(O)[H]
MCULE-2215895979 0.78 C1=C(C)CCC(C)(CCC(CC)O)C1C
MCULE-6062917578 0.78 C/C(/C)=C/CCC1CCC(O)C=1
MCULE-2740451288 0.78 CC(C=C(CC1CCCCC1)C)O
MCULE-7401121675 0.78 CC(CO)=CCCC(CCO)C
MCULE-2262104065 0.78 CCCCCCC=C(C(O)C)C
MCULE-4612448515 0.78 OC/C=C(/CC/C=C(/CCCC(CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CC/C=C(\C)/C)(O)C)\C)\C
MCULE-1889985819 0.78 C/C(/C)=C/C(CC1CCCCC1)(O)C
MCULE-5658893659 0.78 CC(C(C=CCCCCCC)O)C
MolPort-005-306-804 0.78 COc1cc(C=O)c(OC)c(O)c1O
MolPort-023-279-013 0.78 COc1cc(O)c(C(=O)c2cccc(O)c2O)c(OC)c1
MolPort-028-803-024 0.78 COc1cc(C(C)=O)c(OC)cc1OC1CCCC1
MolPort-001-835-023 0.78 CCOc1cc(OCC)c(cc1OCC)C(=O)c1ccccc1
MolPort-035-706-160 0.78 COc1cc(OC)c(cc1OC)C(=O)[C@@H](C)O
MolPort-001-784-479 0.78 CCc1cc(OC)c(C=O)cc1OC
MolPort-000-160-396 0.78 COc1ccc(OC)c(C=O)c1OC
MolPort-001-839-802 0.78 COc1cc(O)c(C=O)cc1OC
MolPort-028-803-024 0.78 COc1cc(C(C)=O)c(OC)cc1OC1CCCC1
MolPort-035-706-160 0.78 COc1cc(OC)c(cc1OC)C(=O)[C@@H](C)O
MolPort-023-279-013 0.78 COc1cc(O)c(C(=O)c2cccc(O)c2O)c(OC)c1
MCULE-6626480267 0.77 C1CC2C(O)C3CC=CCC3C(O)C2CC=1
MCULE-7760721294 0.77 C1CC2(CCCCC2(CO)C(C)C=1)CO
MCULE-8722569228 0.77 C1CC2(C)C(CO)C(C)=CCC2C(CO)(C)C1
MCULE-7364976100 0.77 C1[C@@H](O)[C@]2(C)CC=C(C(C)C)C[C@@]2([H])[C@@](C)(O)C1
MCULE-4778747911 0.77 C1C(O)C2(C)CCC(C(O)(C)C)C=C2C(C)C1
MCULE-2581880996 0.77 C(C)(C)(O)C(O)CC/C(/C)=C/CCC(C)(O)C=C
MCULE-7510220469 0.77 C1CC2[C@@](CC[C@H]([C@]2(C)CCC(C)CC(=O)O)C)(C(=C1)CO)C
MCULE-4154375600 0.77 C12(C(CC=CC1)(CO)CCCC2)CO
MCULE-7446284675 0.77 C1=CC2CCC1C(CO)C2CO
MolPort-009-753-910 0.77 COc1ccc(O)cc1C(C)=O
MolPort-000-000-274 0.77 COc1cc(ccc1O)C(C)=O
MolPort-004-772-954 0.77 COc1c(O)cccc1C(C)=O
MolPort-046-688-606 0.77 [2H]C([2H])([2H])Oc1cc(O)ccc1C(C)=O
MolPort-001-770-292 0.77 COc1cc(O)ccc1C(C)=O
MolPort-001-787-695 0.77 COc1cccc(C(C)=O)c1O
MolPort-005-943-306 0.77 COc1cc(O)cc(O)c1C(C)=O
MolPort-002-117-172 0.77 COc1cc(C)cc2cc(C)c(C(C)=O)c(OC)c12
MolPort-002-818-097 0.77 CCOc1ccccc1C(=O)c1cc(OCC)c(OC)cc1OCC
MolPort-015-137-508 0.77 COc1ccc(C(=O)CCl)c(O)c1OC
MolPort-003-665-697 0.77 COc1cc(O)c(cc1O)C(=O)c1ccccc1
MolPort-001-794-696 0.77 COc1cc(C)c(C=O)c(OC)c1OC
MolPort-046-688-606 0.77 [2H]C([2H])([2H])Oc1cc(O)ccc1C(C)=O
MolPort-000-144-466 0.77 COc1ccc(O)c(c1)C(C)=O
MCULE-8361618515 0.76 OC/C=C(/CC/C=C(/CCC(C(CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CC/C=C(\C)/C)(O)C)O)\C)\C
MCULE-1620592725 0.76 C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CO)CCC(C)C(C)C21[H])[H]
MCULE-6673315997 0.76 C/C(/C)=C/C1(C2(CCCCC2)CC1)O
MCULE-9666470335 0.76 O[C@@]1(CC=C)CC[C@]2([H])[C@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
MCULE-1913114708 0.76 OC/C=C(\C)/CC/C=C(/CCC(C(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(O)(C)CCCC(C)(CCCC(C)(CCCC(O)(C)C)O)O)O)\C
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MCULE-2525177975 0.69 C1=CC2C3C4C(C(CO)C13)C=CC4C2CO
MCULE-4985122843 0.69 C1C([H])(C)C([H])(CO)C([H])(CO)C([H])(C)C=1
MCULE-5362337107 0.69 C12(C)C(C(C)CCC(O)=O)CCC1C1C(CC2O)C2(C)CCC(CC2=CC1O)O
MCULE-2331913954 0.69 NC1C(C(C2CCCCC=2)O)CCC1
MCULE-7720595428 0.69 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-5965392040 0.69 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])[C@H](OC)C=C2C[C@H]1O
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MCULE-4102226627 0.69 NCC(CC1C2C=CC(CC2)C1)O
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MCULE-9532014931 0.69 NC1(CC1)CC(C1CCCCC=1)O
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MCULE-4860388495 0.69 [C@H](C)(CCCC(C)=CCO)CCC[C@H](C)CCCC(C)C
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MCULE-9968073626 0.69 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])[C@@H](OC)C=C2C[C@H]1O
MCULE-3392411245 0.69 [C@]12(O)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)=O
MCULE-1397397840 0.69 O=C1CCC2(O)C3CCC4(C)CC(O)CC4C3CCC2=C1
MCULE-8156503872 0.69 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-2515703397 0.69 C(C)(CCCC(C)CCCC(C)CCCC(C)C)=CCO
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MCULE-1706558387 0.68 CC1(C(CC2CC=CC2)(O)CCC1)C
MCULE-8065006413 0.68 CC1C(CC/C=C(\C)/C)(O)CCCC1
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MCULE-1274107363 0.68 CC(C1(C2C=CC(C2)C1)O)=C
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MCULE-1505073195 0.67 C(C(=O)O)C[C@]1(C)[C@@]2([H])CC[C@]3([C@]([H])([C@H](CC/C=C(\C(O)=O)/C)C)CC[C@]3(C)C2=CC[C@@]1([H])C(C)=C)C
MCULE-4963816026 0.67 O=C1CCC2(C)C3CCC4(C)CCC(O)C4C3CC(O)C2=C1
MCULE-1585616264 0.67 C1[C@@H](O)[C@]2(C)CC[C@]([H])(/C=C(/C)\C)[C@@]2([H])[C@](O)(C)C1
MCULE-8197081732 0.67 CC(CCC1(C2C=CC(C2)C1)O)C
MCULE-4583707938 0.67 OC1(C=CCCC1)CC1C(F)(F)C1
MCULE-2733787463 0.67 CC(C(C(C1CCCCC=1)O)N)(C)C
MCULE-3060260292 0.67 CC(C1(C2C=CC(C2)C1)O)C
MCULE-4282189276 0.67 C1(O)CC2(C)C3CC(O)C4(C)C(C(CCC(O)C(O)(C)C)CO)CCC4(C)C=3CCC2C(C)(C)C1O
MCULE-4640388008 0.67 NC1CC(C(C2CCCCCC=2)O)C1
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MCULE-7022735372 0.67 C1(=O)CC2C(C)(CCC(CC(O)=O)C)C(C)CCC2(C)C(C(O)=O)=C1
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MolPort-029-806-317 0.67 CCCCOc1cc(ccc1OC)C(C)=O
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MolPort-019-724-169 0.66 COc1cc2ccc(C=O)cc2c(OC)c1OC
MolPort-008-611-002 0.66 COc1ccc2ccccc2c1C(C)=O
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MolPort-022-369-990 0.66 CCc1cc(OC)ccc1C=O
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MolPort-002-265-399 0.66 COc1ccc(C(=O)C(C)=O)c(OC)c1
MolPort-022-386-274 0.66 COc1cc(OC)c2ccccc2c1C=O
MolPort-022-386-274 0.66 COc1cc(OC)c2ccccc2c1C=O
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MCULE-6190365385 0.66 C(O)(CC1(C)C(CC(O)=O)(CC=C2C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC12)[H])=O
MCULE-5756833407 0.66 [C@]12(C)[C@H](C)CCC=C1CC[C@@H](C(=C)C)C2
MCULE-2186753253 0.66 C1(CCC=CC1)(CO)CO
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MCULE-4834307131 0.66 OC(C1(CCCC1)O)CC1CC=CC1
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MCULE-3727435032 0.66 C(O)(C1=CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
MCULE-5616785989 0.66 C12(C)C(C)CCC=C1CCC(C(C)=C)C2
MCULE-5192933185 0.66 C([H])(CCCC)=C([H])CCCCO
MCULE-1652497439 0.66 C1C[C@]2(C)CC[C@@H](C(O)(C)C)C[C@@]2([H])C(=C)[C@@H]1O
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MCULE-2789395858 0.66 C1C[C@]2(C)CC[C@@H](C(=C)CO)C[C@@]2([H])[C@@](O)(C)C1
MCULE-5850991547 0.66 C(/C)(\C)=C/CCC(C)C(C)O
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MolPort-001-791-592 0.65 COc1cc(C)cc(OC)c1C=O
MCULE-6994850137 0.65 CC1(CC(CC2CC=CC2)(O)CC1)C
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MCULE-9540310865 0.65 C/C(=C\C=C\C(=C\C=C\C)\C)/C=C/C1C(C)(C)CC(O)C=C1C
MolPort-001-762-575 0.65 COc1cc(C=O)c(OC)cc1C=O
MCULE-5785045084 0.65 CC1C(C)C(CC2CC=CC2)(O)C1
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MCULE-7349150015 0.65 OC(C1(C(F)F)CC1)C1CCCCC=1
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MCULE-5565969618 0.65 CC(C(F)(F)F)(C1CCCCC=1)O
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MCULE-7814345154 0.65 CC(C1CCCCCCC=1)(C(F)F)O
MolPort-000-996-582 0.65 CCOc1cc(C=O)cc(CC=C)c1OC
MCULE-2778170549 0.65 O[C@]1(CC=C(C)CC1)C(C)C
MolPort-002-469-584 0.65 COc1cc(Cl)c(cc1OC)C(C)=O
MCULE-4943208576 0.65 C1C[C@@]2([H])[C@]3([H])CC[C@@]4(C)[C@@](O)(C#C)CC[C@]4([H])[C@@]3([H])CCC2=CC1
MolPort-002-092-851 0.65 CNC(=O)c1cc(OC)c(OC)cc1OC
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MCULE-9666104558 0.65 CC1C(C(CC2CC=CC2)(O)C)C1
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MCULE-8752174219 0.65 CCOC1CCC(=CC(O)C)CC1
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MCULE-9910993861 0.64 [C@]12(C)CCC/C(=C\C=C3\C[C@@H](O)CCC\3=C)/[C@]1([H])CC[C@@H]2[C@H](C)/C=C/C(C)(O)C(C)(C)O
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MCULE-6548923859 0.64 [C@@]12(C)CC[C@@]3([H])C(C)(C)[C@H](CC[C@]3(C)[C@@]1([H])C[C@@H](O)[C@]1([C@@]2(C)CC[C@]1([H])[C@](C)(O)CC/C=C(/C)\C)[H])O
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MolPort-000-557-977 0.64 Oc1ccc(C(=O)c2ccccc2)c(O)c1O
MCULE-9073699986 0.64 [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
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MCULE-8485688872 0.64 [H]C12C(C)(CC=CC1)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
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MCULE-4929710192 0.64 C[C@@]1(CCC[C@@]2(C)[C@@]3([H])[C@]4(C[C@](CC3)([H])C(C(=O)O)=C4)CC[C@]12[H])CO
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MCULE-4769256552 0.64 CC(C1CCCCCC=1)(C(F)F)O
MolPort-004-294-280 0.64 COc1cc(ccc1OCCC(O)=O)C(C)=O
MCULE-4912421491 0.64 CC(C1(CC1)Cl)(C1CCCCC=1)O
MolPort-000-159-267 0.64 COc1ccc(CC(O)=O)c(OC)c1OC
MCULE-4342429616 0.64 CC(C(F)(F)F)(C1CCCCCC=1)O
MolPort-002-204-906 0.64 COc1cc(C=O)ccc1OCCOc1ccc(C)cc1C(C)(C)C
MCULE-2846082692 0.64 C(C(C1(C)C2C(C2C(=O)C=C1C(O)=O)(C)C)C)C(O)=O
MolPort-002-202-730 0.64 COc1cc(C=O)ccc1OCCCOc1ccc(C)cc1C(C)(C)C
MCULE-6491026495 0.64 COC1C(C(C2CCCCC=2)O)C1
MolPort-006-394-330 0.64 CCOCOc1cc(O)c(C(C)=O)c(OCOCC)c1
MCULE-2847349308 0.64 [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
MolPort-002-894-884 0.64 COc1ccc(OC)c(c1)C(=O)c1ccc(Cl)cc1
MCULE-1734725499 0.64 C/C(/C)=C/C(C1CCC(N)CC1)O
MolPort-001-792-662 0.64 COc1ccc(OC)c(c1)C(=O)c1ccc(cc1)C(O)=O
MCULE-9929984425 0.64 OCC1(C2C3CC(CC3)C2)CC=CC1
MolPort-000-249-001 0.64 COc1cc(C=O)cc(CC=C)c1O
MCULE-3079438380 0.64 CCC(C(C1CCCCCC=1)O)(F)F
MolPort-002-204-787 0.64 COc1cc(C=O)ccc1OCCOc1cccc(c1)C(C)C
MCULE-3830151128 0.64 NC1(C(C2CCCCCC=2)O)CC1
MolPort-002-747-972 0.64 COc1ccc(cc1OC)C(=O)c1ccc(F)cc1
MCULE-7835659960 0.64 C/C(/C)=C/CCC1(C2C(C2)CC1)O
MolPort-027-354-140 0.64 CCCC(=O)c1cc(OC)cc(OC)c1
MCULE-2115945080 0.64 C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2N)C)O
MolPort-004-098-063 0.64 COc1cc(cc(OC)c1OC)C(=O)COC(=O)c1cccc2ccccc12
MCULE-1781105765 0.64 C1(CCCC=C1)(CN)O
MolPort-011-182-337 0.64 CCCCCC(=O)c1ccc(OC)c(OC)c1
MCULE-4753796367 0.64 C1(O)CC2(C(CCC(C2CC/C(/C)=C/C(=O)O)=C)C(C)(C1)C(O)=O)C
MolPort-011-529-161 0.64 COc1ccc(cc1OC)C(=O)C(C)Br
MCULE-9020191331 0.64 C1C[C@]2(C)[C@@]3([H])C[C@@H](O)[C@]4([H])[C@@]([H])([C@](C)(CC/C=C(/C)\C)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
MolPort-044-251-327 0.64 COc1ccc(OC)c(c1)C(=O)C=Cc1cc(OC)c(OC)c(OC)c1
MCULE-1572938680 0.64 C1C[C@]2(C)[C@@]3([H])C[C@@H](O)[C@]4([H])[C@@]([H])([C@](C)(CC/C=C(\C)/C)O)CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2([H])C(C)(C)[C@H]1O
MolPort-046-419-260 0.64 CC(=O)c1cc(OCc2ccccc2)ccc1OCc1ccccc1
MCULE-7491068561 0.64 [C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1C[C@@H](C)[C@@H]2C(C)=O
MolPort-002-200-980 0.64 COc1cc(C=O)ccc1OCCCCOc1ccccc1C(C)(C)C
MCULE-9672606479 0.64 [C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CCCC(C)=O
MolPort-005-230-938 0.64 COc1ccc(OC)c(c1)C(=O)CC(C)=O
MCULE-3560182453 0.64 C1C[C@]2([C@]3([H])CC[C@H]4C(C(=O)O)=C[C@@]3(C4)CC[C@]2([H])[C@@](C)(CO)C1)C
MolPort-005-933-071 0.64 Oc1ccc(C(=O)c2cc(O)c(O)c(O)c2)c(O)c1O
MCULE-2258281526 0.64 C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC12CO1
MolPort-002-560-214 0.64 Oc1ccc(cc1)C(=O)c1ccc(O)c(O)c1O
MCULE-2411412323 0.64 C1C[C@@]2([C@@]([H])([C@@](C(O)=O)(C)C1)CC[C@@]13C2=CC[C@]([H])(C(=C)C1)C3)C
MolPort-005-837-158 0.64 COc1cc(ccc1OCC(O)COc1ccc(cc1OC)C(C)=O)C(C)=O
MCULE-8721262408