SANC01074 Erythrinasinate B




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-3236344932 1 C(CCCCCCCC)CCCCCCCCCCCOC(=O)/C=C/C1C=C(OC)C(O)=CC=1
MCULE-8929078677 1 C(CCCCCCCCCCCCCCCC)CCCCCCCCCCCOC(=O)/C=C/C1C=C(OC)C(O)=CC=1
MCULE-1514237588 1 C(OCCCCCCCCCCCCCCCCCCCCCCCCCC)(=O)/C=C/C1=CC=C(O)C(OC)=C1
MolPort-023-298-977 1 CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-000-165-442 1 CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-035-683-143 1 CCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-001-742-211 1 CCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(OC)c1
MCULE-3645261393 0.97 C12(C)CCC(CC1OC(=O)/C=C/C1C=CC(=C(OC)C=1)O)C2(C)C
MolPort-001-742-377 0.97 COc1cc(\C=C\C(=O)OC2CC3CCC2(C)C3(C)C)ccc1O
MCULE-5685931548 0.96 COC1=C(OC)C=C(C=CC(OC2CCC(C(C)(C)C)CC2)=O)C=C1
MolPort-044-278-546 0.96 COc1ccc(C=CC(=O)OC2CCC(CC2)C(C)(C)C)cc1OC
MCULE-3857403683 0.92 COC1=C(OC)C(OC)=CC(C=CC(OC2CCC(C(C)(C)C)CC2)=O)=C1
MolPort-044-278-557 0.92 COc1cc(C=CC(=O)OC2CCC(CC2)C(C)(C)C)cc(OC)c1OC
MCULE-8914274512 0.91 C(CCCCCCCCCC)CCCCCCCCCCCOC(=O)/C=C/C1C=C(O)C(O)=CC=1
MCULE-2454886969 0.91 C1(O)C=C(/C=C/C(OCCCCCCCCCCCCCCCCCC)=O)C=CC=1O
MolPort-039-063-519 0.91 CCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-023-298-972 0.91 CCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1
MCULE-9000275415 0.90 COC1=C(OC)C(OC)=CC(C=CC(OC2CCCCC2)=O)=C1
MolPort-009-497-345 0.90 COc1cc(C=CC(=O)OC2CCCCC2)cc(OC)c1OC
MCULE-4433481769 0.88 C1C=C(/C=C/C(=O)OCC(CCCC)CC)C=CC=1OC
MCULE-6787528773 0.88 C(OCC(CCCC)CC)(=O)C=CC1=CC=C(OC)C=C1
MCULE-3489677351 0.88 C(=CC1C=CC(OC)=CC=1)C(OCCCCCCCCCCCCCCCC)=O
MolPort-001-768-875 0.88 CCCCC(CC)COC(=O)\C=C\c1ccc(OC)cc1
MolPort-046-763-153 0.88 [2H]C([2H])([2H])Oc1ccc(\C=C\C(=O)OCC(CC)CCCC)cc1
MCULE-1819544438 0.87 CC(C1C2(C)CCC34CC53CCC(OC(C=CC3C=CC(O)=C(OC)C=3)=O)C(C)(C)C5CCC4C2(C)CC1)CC/C=C(\C)/C
MolPort-046-682-171 0.87 COc1cc(\C=C\C(=O)OC2CCC34CC33CCC5(C)C(CCC5(C)C3CCC4C2(C)C)C(C)CCC=C(C)C)ccc1O
MolPort-046-033-577 0.87 COc1cc(\C=C\C(=O)O[C@H]2CC[C@]34C[C@]33CC[C@]5(C)[C@H](CC[C@@]5(C)[C@@H]3CC[C@H]4C2(C)C)[C@H](C)CCC=C(C)C)ccc1O
MolPort-046-701-409 0.87 COc1cc(C=CC(=O)O[C@H]2CC[C@]34CC33CC[C@]5(C)[C@H](CC[C@@]5(C)C3CCC4C2(C)C)[C@H](C)CCC=C(C)C)ccc1O
MolPort-038-941-800 0.87 COc1cc(\C=C\C(=O)O[C@H]2CC[C@]34CC33CC[C@]5(C)[C@H](CC[C@@]5(C)C3CCC4C2(C)C)[C@H](C)CCC=C(C)C)ccc1O
MolPort-020-005-667 0.87 COc1cc(\C=C\C(=O)O[C@H]2CC[C@]34CC33CC[C@]5(C)[C@H](CC[C@@]5(C)C3CCC4C2(C)C)C(C)CCC=C(C)C)ccc1O
MCULE-9475456640 0.86 COC1=C(OC)C=C(C=CC(OC2C(=O)CCCC2)=O)C=C1
MolPort-044-212-299 0.86 COc1ccc(C=CC(=O)OC2CCCCC2=O)cc1OC
MCULE-4121085614 0.85 COC1=C(O)C=CC(C=CC(OCC(C(C)(C)C)=O)=O)=C1
MolPort-044-227-583 0.85 COc1cc(C=CC(=O)OCC(=O)C(C)(C)C)ccc1O
MCULE-1639909332 0.84 COC1=C(O)C=CC(C=CC(OCC(OC2C(C(C)C)CCC(C)C2)=O)=O)=C1
MolPort-046-158-411 0.84 COC(=O)[C@@]1(O)C[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(OC)c2)[C@H](O)C1
MolPort-019-936-817 0.84 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)C[C@@](O)(C[C@H]2O)C(O)=O)ccc1O
MolPort-035-706-380 0.84 CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)c(O)c6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
MolPort-039-063-543 0.84 CCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)cc1
MolPort-044-377-302 0.84 COc1cc(C=CC(=O)OCC(=O)OC2CC(C)CCC2C(C)C)ccc1O
MCULE-9650359988 0.83 C1C=C(C=C(C=1O)OC)/C=C/C(=O)O[C@H]1[C@H](O)C[C@](O)(C(O)=O)C[C@H]1O
MCULE-5036325620 0.83 COC1=C(OC)C=C(C=CC(OCC(C(C)(C)C)=O)=O)C=C1
MCULE-1904758351 0.83 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-3504325811 0.83 C(=CC1=CC=C(C(OC)=C1)OCCCCCC)C(OCC)=O
MolPort-039-052-560 0.83 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)c(O)c6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
MolPort-044-212-298 0.83 COc1ccc(C=CC(=O)OCC(=O)C(C)(C)C)cc1OC
MCULE-5548184832 0.82 COC1=C(OC)C(OC)=CC(C=CC(OC2C(=O)CCCC2)=O)=C1
MCULE-9005132679 0.82 C1[C@]2(C(C)(C)[C@]([H])(C[C@H]2OC(=O)/C=C/C2C=CC(O)=CC=2)C1)C
MCULE-3227837163 0.82 O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC(C)C
MolPort-035-706-108 0.82 CC1(C)[C@H]2CC[C@]1(C)[C@@H](C2)OC(=O)\C=C\c1ccc(O)cc1
MolPort-005-934-262 0.82 COc1cc(\C=C\C(=O)OC(C)C)ccc1O
MolPort-044-213-165 0.82 COc1cc(C=CC(=O)OC2CCCCC2=O)cc(OC)c1OC
MCULE-7448324880 0.81 C12C(C(=C)C)CCC1(COC(=O)C=CC1C=CC(OC)=CC=1)CCC1(C)C3(C)CCC4C(C)(C)C(CCC4(C)C3CCC21)O
MCULE-5563428797 0.81 COC1=CC=C(C=CC(OCCC(C)C)=O)C=C1
MolPort-000-756-898 0.81 COc1ccc(\C=C\C(=O)OCC23CCC(C2C2CCC4[C@@]5(C)CCC(OC(=O)\C=C\c6ccc(OC)cc6)C(C)(C)C5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)cc1
MolPort-000-737-656 0.81 COc1ccc(\C=C\C(=O)OCC23CCC(C2C2CCC4C5(C)CCC(O)C(C)(C)C5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)cc1
MolPort-002-530-487 0.81 COc1ccc(\C=C\C(=O)OC[C@]23CC[C@H]([C@H]2C2CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(OC)cc6)C(C)(C)C5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)cc1
MolPort-002-527-982 0.81 COc1ccc(\C=C\C(=O)OC[C@]23CC[C@H]([C@H]2C2CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)cc1
MolPort-002-140-550 0.81 COc1ccc(\C=C\C(=O)OCCC(C)C)cc1
MolPort-046-596-361 0.81 COc1ccc(\C=C\C(=O)OCC23CCC(C2C2CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)cc1
MolPort-023-132-867 0.81 COc1ccc(C=CC(=O)OCCC(C)C)cc1
MolPort-019-904-624 0.80 CCOC(=O)C=Cc1ccc(O)c(OC)c1
MolPort-028-570-660 0.80 O=C(OCC(=O)C12CC3CC(CC(C3)C1)C2)C=Cc1ccc2OCOc2c1
MolPort-028-570-661 0.80 CC(OC(=O)C=Cc1ccc2OCOc2c1)C(=O)C12CC3CC(CC(C3)C1)C2
MolPort-039-338-682 0.80 COC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-039-338-681 0.80 COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-046-691-606 0.80 CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)\C=C\c1ccc(O)c(OC)c1)C(C)C
MolPort-005-944-613 0.80 COc1ccc(\C=C\C(=O)OC2C(O)CC(O)(CC2O)C(O)=O)cc1O
MolPort-001-763-851 0.80 CCOC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-001-740-183 0.80 COc1cc(\C=C\C(=O)O[C@@H]2C[C@@](O)(C[C@@H](O)[C@H]2O)C(O)=O)ccc1O
MolPort-044-377-904 0.80 CCCCOC(=O)C(=Cc1ccc(O)c(OC)c1)C#N
MolPort-046-764-814 0.80 COc1cc(\C=C\C(=O)O[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](CC[C@@H]5[C@@H]4CC=C3C2)C(C)CC[C@@H](C)C(C)C)ccc1O
MolPort-046-764-815 0.80 CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)\C=C\c1ccc(O)c(OC)c1)C(C)C
MCULE-8111104173 0.80 [C@](COC(=O)/C=C/C1C=CC(O)=C(OC)C=1)([H])(CC1C=CC(O)=C(OC)C=1)[C@@](COC(=O)/C=C/C1C=C(OC)C(O)=CC=1)([H])CC1C=C(OC)C(O)=CC=1
MCULE-9514321609 0.80 C1C(=CC(O)=C(C=1)OC)/C=C/C(=O)OC1C(O)CC(C(=O)O)(O)CC1O
MCULE-4743217929 0.80 C1(=C(C=CC(=C1)C=CC(=O)OCC)O)OC
MCULE-8928982037 0.80 C1(OC)C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-6146987885 0.80 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-4959928632 0.80 C(=CC1=CC=C(C(OC)=C1)OCCCCCC)C(OC)=O
MCULE-3872970596 0.80 C(=CC1=CC=C(C(OC)=C1)OCCCCC)C(OCC)=O
MCULE-2354679869 0.80 C1[C@@](O)(C(OC)=O)C[C@@H](OC(=O)/C=C/C2C=C(OC)C(O)=CC=2)[C@H](O)[C@@H]1O
MCULE-4850783882 0.80 C1[C@@](O)(C(OC)=O)C[C@@H](O)[C@H](O)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-4848323725 0.80 CCOC1=CC=C(C=CC(OC2(C3CC3)CC2)=O)C=C1
MCULE-1441791124 0.80 C1[C@@](C(O)=O)(C[C@H]([C@@H]([C@@H]1OC(/C=C/C1C=C(OC)C(O)=CC=1)=O)O)O)O
MCULE-4650415194 0.80 C1[C@@](C(O)=O)(C[C@H]([C@@H]([C@@H]1O)O)OC(=O)/C=C/C1C=C(OC)C(O)=CC=1)O
MCULE-7170100562 0.80 CCCCOC(C(C#N)=CC1=CC(OC)=C(O)C=C1)=O
MolPort-023-179-842 0.80 CCOc1ccc(C=CC(=O)OC2(CC2)C2CC2)cc1
MolPort-001-740-625 0.80 COc1cc(\C=C\C(=O)O[C@@H]2C[C@](O)(C[C@@H](O)[C@@H]2O)C(O)=O)ccc1O
MolPort-035-706-056 0.80 COc1cc(C[C@@H](COC(=O)\C=C\c2ccc(O)c(OC)c2)[C@H](COC(=O)\C=C\c2ccc(O)c(OC)c2)Cc2ccc(O)c(OC)c2)ccc1O
MolPort-000-762-687 0.79 CC(=O)OC[C@]12CC[C@H](C1C1CCC3[C@@]4(C)CC[C@H](OC(=O)\C=C\c5ccc(OC(C)=O)c(OC(C)=O)c5)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-044-239-680 0.79 COc1cc(C=CC(=O)OCCCc2ccccc2)cc(OC)c1OC
MolPort-044-408-808 0.79 COc1cc(C=CC(=O)OCC(=O)OC2CC(C)CCC2C(C)C)cc(OC)c1OC
MolPort-046-158-500 0.79 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)c(O)c6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
MCULE-5938473801 0.79 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-4362142668 0.79 COC1=C(OC)C(OC)=CC(C=CC(OCC(OC2C(C(C)C)CCC(C)C2)=O)=O)=C1
MCULE-7258402916 0.79 COC1=C(OC)C(OC)=CC(C=CC(OCCCC2=CC=CC=C2)=O)=C1
MCULE-2664833082 0.79 COC1=C(OC)C(C=CC(OC2C(=O)CCCC2)=O)=CC=C1
MolPort-009-649-049 0.78 COc1ccc(\C=C\C(=O)O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CCC5C4CC=C3C2)[C@H](C)CCCC(C)C)cc1OC
MolPort-002-508-493 0.78 CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)\C=C\c1ccc(OC)c(OC)c1
MolPort-001-765-950 0.78 CCOC(=O)\C=C\c1ccc(OC)c(OC)c1
MolPort-003-845-560 0.78 COc1cc(\C=C\C(=O)OCCc2ccccc2)ccc1O
MolPort-009-674-147 0.78 COC(=O)C=Cc1ccc(O)c(OC)c1
MolPort-001-786-899 0.78 COC(=O)\C=C\c1ccc(O)c(OC)c1
MolPort-046-597-764 0.78 COc1ccc(\C=C\C(=O)O[C@H]2CC[C@]3(C)C4CC[C@]5(C)C(CCC5C4CC=C3C2)C(C)CCCC(C)C)cc1OC
MolPort-044-411-158 0.78 COc1ccc(C=CC(=O)OCC2C(COC(=O)C=Cc3ccc(OC)c(OC)c3)C2(Cl)Cl)cc1OC
MolPort-044-183-416 0.78 COc1cc(\C=C\COC(=O)CCCC\C=C\C(C)C)ccc1O
MolPort-044-216-058 0.78 COc1ccc(C=CC(=O)OC2CCCCC2=O)cc1
MolPort-027-853-674 0.78 COc1cc(\C=C\C(=O)O[C@@H]2C[C@@](O)(C[C@@H](O)[C@H]2OC(=O)\C=C\c2ccc(O)c(OC)c2)C(O)=O)ccc1O
MolPort-044-215-001 0.78 COc1cccc(C=CC(=O)OC2CCCCC2=O)c1OC
MCULE-5022584631 0.78 C1[C@@](O)(C(O)=O)C[C@@H](OC(=O)/C=C/C2C=C(OC)C(O)=CC=2)[C@H](OC(/C=C/C2C=C(OC)C(O)=CC=2)=O)[C@@H]1O
MCULE-3389166738 0.78 [C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-4333230989 0.78 [C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C=CC3C=CC(=C(OC)C=3)OC)C1CC[C@]2([H])[C@H](C)CCCC(C)C
MCULE-7925803308 0.78 C(=CC1C=CC(=C(OC)C=1)OC)C(OCC)=O
MCULE-2429207575 0.78 C(=CC1=CC=C(C(OC)=C1)OCCCCC)C(OC)=O
MCULE-5856998231 0.78 COC1=CC=C(C=CC(OC2C(=O)CCCC2)=O)C=C1
MCULE-7084750759 0.78 C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)OC
MCULE-3372272074 0.78 COC1=C(OC)C=C(C=CC(OCC2C(Cl)(Cl)C2COC(C=CC2=CC(OC)=C(OC)C=C2)=O)=O)C=C1
MCULE-1297302420 0.78 C(=CC1C=CC(O)=C(OC)C=1)C(OC)=O
MolPort-035-682-954 0.77 CCOC(=O)\C=C\c1ccc(OC)c(O)c1
MolPort-039-338-802 0.77 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)C[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C2(C)C)ccc1O
MolPort-035-706-379 0.77 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
MolPort-039-338-280 0.77 C[C@@]1(O)CC[C@H]2[C@@](C)(COC(=O)\C=C\c3ccc(O)cc3)CCC[C@]2(C)[C@H]1CCC(=C)C=C
MolPort-039-063-541 0.77 COc1cc(\C=C\C(=O)OCCc2ccc(O)cc2)ccc1O
MolPort-000-732-164 0.77 COc1ccc(\C=C\C(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1OC
MolPort-002-466-072 0.77 CCCCCCCOc1ccc(\C=C\C(O)=O)cc1OC
MCULE-3302207880 0.77 C1(O)=CC=C(C=CC(=O)OCC=CC2C=CC(O)=C(OC)C=2)C=C1OC
MCULE-8675181272 0.77 O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC/C=C/C1C=C(OC)C(O)=CC=1
MCULE-4032499796 0.77 C1C[C@]2(C)[C@@]([H])(CCC(C=C)=C)[C@](C)(O)CC[C@@]2([H])[C@@](C)(COC(=O)/C=C/C2C=CC(O)=CC=2)C1
MCULE-3668855470 0.77 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCCCC
MCULE-3071903278 0.77 C1(OC)C=C(/C=C/C(OCCC2C=CC(O)=CC=2)=O)C=CC=1O
MCULE-9137341976 0.77 C(=CC1C=CC(=C(OC)C=1)OCCC(C)C)C(OCC)=O
MCULE-4679745199 0.77 C(OCCC1=CC=C(O)C=C1)(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-7418788361 0.77 CCCCCCCOC1=C(OC)C=C(C=CC(O)=O)C=C1
MCULE-9619592702 0.77 N12CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3731871472 0.77 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCCC(C)C
MCULE-8145716061 0.77 C(=CC1C=CC(=C(OC)C=1)OCCCC)C(OCC)=O
MCULE-5669498323 0.77 C(O)(C=CC1=CC=C(OCCCCCCCCCCCCCCCC)C(OC)=C1)=O
MCULE-8291716022 0.77 C1(O)C=C(/C=C/C(=O)OCC)C=CC=1OC
MolPort-000-640-498 0.76 CCCCCCCCOc1ccc(\C=C\C(O)=O)cc1OCCCCCCCC
MolPort-003-845-559 0.76 COc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1OC
MolPort-019-879-052 0.76 OC1CC(O)(CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1)C(O)=O
MolPort-002-551-646 0.76 CCCCCCCCCCOC(=O)C(=C/c1ccc(OC)cc1)\C#N
MolPort-001-740-202 0.76 O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-039-052-416 0.76 COc1cc(\C=C\C(=O)O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3C=C[C@]35OC(=O)[C@@]6(CC[C@@H](C)[C@H](C)C36)CC[C@@]45C)C2(C)C)ccc1O
MolPort-001-512-009 0.76 COC(=O)\C=C\c1ccc(OC)c(OC)c1
MolPort-009-021-706 0.76 COC(=O)C=Cc1ccc(OC)c(OC)c1
MolPort-044-273-364 0.76 O=C(OC1(CCCC1)C#N)C=Cc1ccc2OCOc2c1
MolPort-039-309-364 0.76 CCOC(=O)\C=C\c1cc(OC)c(O)c(OC)c1
MolPort-020-159-320 0.76 CCOC(=O)C=Cc1cc(OC)c(O)c(OC)c1
MolPort-044-214-116 0.76 CC(C)(C)C(=O)COC(=O)C=Cc1ccc2OCOc2c1
MolPort-039-338-654 0.76 COC(=O)[C@@]1(O)C[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)C1
MolPort-021-804-713 0.76 O[C@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-044-408-415 0.76 CC(C)C1CCC(C)CC1OC(=O)COC(=O)C=Cc1ccc2OCOc2c1
MolPort-044-227-586 0.76 COc1cc(C=CC(=O)OCC(=O)COC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
MolPort-044-380-777 0.76 COc1cc(C=CC(=O)OCCCOC(=O)C=Cc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
MolPort-027-853-660 0.76 COc1ccc(\C=C\C(=O)O[C@H]2[C@H](O)C[C@@](O)(C[C@H]2OC(=O)\C=C\c2ccc(O)c(O)c2)C(O)=O)cc1O
MolPort-044-228-661 0.76 CCCCOC(=O)C(=Cc1ccc(O)c(OCC)c1)C#N
MolPort-002-857-374 0.76 CCCCCCCCOc1ccc(\C=C\C(=O)OC)cc1
MCULE-8081404420 0.76 C1(=CC=C(O)C(OCC)=C1)C=C(C(=O)C)C(=O)OCC
MCULE-8538730161 0.76 O=C(OCC(CC)CCCC)C(C#N)=CC1C=CC(OC)=CC=1
MCULE-1783535798 0.76 C(C#N)(=CC1=CC=C(C=C1)OC)C(OCCCCCCCCCC)=O
MCULE-8793323224 0.76 C(=CC1=CC=CC=C1)C(OCCCCCCCCCCCCCCCC)=O
MCULE-4366878776 0.76 O=C(C=CC1=CC2=C(OCO2)C=C1)OC1(C#N)CCCC1
MCULE-7411005425 0.76 CCOC(C=CC1=CC(OC)=C(O)C(OC)=C1)=O
MCULE-5863166290 0.76 C1(OC)=C(O)C(OC)=CC(/C=C/C(=O)OCC)=C1
MCULE-2134698260 0.76 CCCCOC(C(C#N)=CC1=CC(OCC)=C(O)C=C1)=O
MCULE-7108051161 0.76 CC(C(COC(C=CC1=CC2=C(OCO2)C=C1)=O)=O)(C)C
MCULE-7663712113 0.76 C(OC(C)C)(=O)C=CC1C=CC(=C(OCC)C=1)OCCCC
MCULE-3492494338 0.76 C1(C=CC(=O)OCCCC)=C(OC)C=C(C=CC(=O)OCCCC)C(OC)=C1
MCULE-1979978934 0.76 C(O)(=O)C=CC1=CC=C(C(OCCCCCCCC)=C1)OCCCCCCCC
MCULE-7869480676 0.76 C(=CC1C=CC(=C(OCC)C=1)OCCCC)C(OCC)=O
MCULE-7774955757 0.76 C1C(O)(C(O)=O)CC(O)C(OC(C=CC2C=CC(O)=C(O)C=2)=O)C1O
MCULE-8174624502 0.76 C1[C@](C(O)=O)(O)C[C@H](O)[C@H](OC(/C=C/C2C=CC(O)=C(O)C=2)=O)[C@@H]1O
MCULE-4406209636 0.76 C1[C@@](O)(C(OC)=O)C[C@@H](O)[C@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@@H]1O
MCULE-7852282089 0.76 C1[C@@](O)(C(=O)O)C[C@H]([C@@H]([C@@H]1O)OC(=O)/C=C/C1C=C(O)C(O)=CC=1)O
MCULE-5055077991 0.76 O=C(C=CC1=CC=C(O)C(O)=C1)O[C@@]1([C@@](C[C@](C(O)=O)(O)C[C@]1(O)[H])(O)[H])[H]
MCULE-5564520710 0.76 O=C(O)[C@@]1(C[C@@H](O)[C@H](OC(=O)C=CC2C=C(O)C(O)=CC=2)[C@H](O)C1)O
MCULE-5040112249 0.76 CC(C1C(OC(COC(C=CC2=CC3=C(OCO3)C=C2)=O)=O)CC(C)CC1)C
MCULE-1947701492 0.76 C(=CC1C=CC(=C(OC)C=1)OC)C(OC)=O
MCULE-7832309540 0.76 COC1=C(OC)C(OC)=CC(C=CC(OCCCOC(C=CC2=CC(OC)=C(OC)C(OC)=C2)=O)=O)=C1
MCULE-5170571415 0.76 COC1=C(OC(C)C)C=CC(C=CC(OC(C)C)=O)=C1
MCULE-9517592357 0.76 C(=CC1C=CC(=CC=1)OCCCCCCCC)C(OC)=O
MCULE-5384523851 0.76 CCOC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-1917208983 0.76 C(O)(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-7304672363 0.76 COC1=C(O)C=CC(C=CC(OCC(COC(C=CC2=CC(OC)=C(O)C=C2)=O)=O)=O)=C1
MCULE-5902675061 0.76 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCC
MCULE-2994486927 0.76 C(=C/C1C=CC(=C(OC)C=1)OC)\C(OC)=O
MolPort-027-639-013 0.75 CCOC(=O)C=Cc1cccc(OC)c1
MolPort-028-755-162 0.75 CCOC(=O)\C=C\c1cccc(OC)c1
MolPort-021-804-461 0.75 COc1cc(\C=C\C(=O)O[C@@H]2[C@H](O)C[C@](O)(C[C@H]2OC(=O)\C=C\c2ccc(O)c(O)c2)C(O)=O)cc(OC)c1O
MolPort-044-295-614 0.75 CCOC(=O)C(=Cc1cc(OC)c(OC)c(OC)c1)C(C)=O
MolPort-000-653-703 0.75 O=C(OC12CC3CC(CC(C3)C1)C2)\C=C\c1ccccc1
MolPort-000-653-702 0.75 O=C(OCC12CC3CC(CC(C3)C1)C2)\C=C\c1ccccc1
MolPort-039-052-617 0.75 COc1cc(\C=C\C(=O)OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O
MCULE-9610575381 0.75 C1[C@](C(=O)O)(O)C[C@@H](O)[C@H](OC(=O)/C=C/C2=CC(O)=C(OC)C=C2)[C@@H]1OC(=O)/C=C/C1=CC(=C(C=C1)O)O
MCULE-1102982179 0.75 C1(OC(=O)C=CC2C=CC=CC=2)CC(C)CCC1C(C)C
MCULE-6479834146 0.75 C12(COC(=O)C=CC3C=CC=CC=3)CC3CC(CC(C3)C1)C2
MCULE-6805134304 0.75 C12(CC3CC(CC(C3)C1)C2)OC(=O)C=CC1C=CC=CC=1
MCULE-1161614746 0.75 C1(C)(C)C(C)CCC1(C)COC(=O)C=CC1C=CC=CC=1
MCULE-6132995974 0.75 CCOC(C=CC1=CC(OC)=CC=C1)=O
MCULE-5513616351 0.75 [C@H]1(COC(=O)/C=C/C2C=CC(O)=C(OC)C=2)OC(O)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-6355599406 0.75 CCOC(C(C(C)=O)=CC1=CC(OC)=C(OC)C(OC)=C1)=O
MCULE-1723949511 0.75 C(OC(C)C)(=O)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-9552658489 0.75 COC1=C(OC)C=C(C=CC(OCCCC(C2=CC=C(F)C=C2)C2=CC=C(F)C=C2)=O)C=C1
MolPort-000-652-347 0.74 CCOC(=O)C(=C/c1ccc(O)c(OC)c1)\C#N
MolPort-001-026-728 0.74 CCOC(=O)C(=C\c1ccc(O)c(OC)c1)\C#N
MolPort-002-713-003 0.74 COc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)ccc1O
MolPort-008-157-830 0.74 C[C@]12CCC3C(CC[C@H]4CCCC[C@]34C)C1CCC2OC(=O)\C=C\c1ccccc1
MolPort-019-872-288 0.74 CCOC(=O)\C=C\c1ccc(OCC)c(OC)c1
MolPort-002-130-650 0.74 CCCCOC(=O)\C=C\c1ccc(OC(=O)OC)c(OC(=O)OC)c1
MolPort-003-848-909 0.74 COC(=O)\C=C\c1ccc(OC)c(O)c1
MolPort-022-394-893 0.74 COC(=O)\C=C\c1cc(OC)c(O)c(OC)c1
MolPort-044-389-980 0.74 COc1ccc(C=CC(=O)OCCCC(c2ccc(F)cc2)c2ccc(F)cc2)cc1OC
MolPort-044-377-230 0.74 COc1cc(C=C(C#N)C(=O)OC(C)C)ccc1O
MolPort-021-805-144 0.74 CCOC(=O)C(=C\c1ccc([O-])c(OC)c1)\C#N
MolPort-044-389-987 0.74 COc1ccc(C=CC(=O)OCC#N)cc1OC
MolPort-035-749-040 0.74 COC(=O)C=Cc1ccc(OC)c(O)c1
MolPort-044-260-680 0.74 CCOc1ccc(C=CC(=O)OC2CCC(C2)C#N)cc1
MolPort-046-590-322 0.74 COc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O
MolPort-044-208-461 0.74 COc1cc(C=CC(=O)OCC(=O)C(C)(C)C)ccc1OCC#N
MolPort-044-212-109 0.74 C=CCOc1ccc(C=CC(=O)OC2CCCCC2=O)cc1
MCULE-3433723647 0.74 COC1=C(OCC#N)C=CC(C=CC(OCC(C(C)(C)C)=O)=O)=C1
MCULE-6949755830 0.74 C=CCOC1=CC=C(C=CC(OC2C(=O)CCCC2)=O)C=C1
MCULE-7259208734 0.74 C1(=CC(=CC=C1OC(OC)=O)C=CC(OCCCC)=O)OC(OC)=O
MCULE-9862807870 0.74 C1(=CC=C(/C=C(\C(=O)OCCCCCCCCCCC)/C(=O)OCCCCCCCCCCC)C=C1)O
MCULE-3470669316 0.74 C1(O)C=CC(/C=C(\C(=O)OCCCCCCCCC)/C(=O)OCCCCCCCCC)=CC=1
MCULE-1084076431 0.74 COC(C=CC1=CC(OC)=C(OCCC(C)C)C=C1)=O
MCULE-8843611321 0.74 C1(=CC=C(C=C1)/C=C(\C(=O)OCCCCCCCCCCCC)/C(=O)OCCCCCCCCCCCC)O
MCULE-3233601291 0.74 C1(C=CC(/C=C(\C(=O)OCCCCCCCCCCCCCCCCCC)/C(OCCCCCCCCCCCCCCCCCC)=O)=CC=1)O
MCULE-8501623633 0.74 CCCCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-5816744415 0.74 C1(=CC=C(/C=C(\C(=O)OCCCCCCCCCC)/C(=O)OCCCCCCCCCC)C=C1)O
MCULE-9485156116 0.74 C(OCCC1=CC=CC=C1)(=O)C=CC1=CC=C(OC)C(O)=C1
MCULE-5123719078 0.74 C1(O)C=CC(=CC=1)/C=C(\C(=O)OCCCCCCCC)/C(=O)OCCCCCCCC
MCULE-9996808027 0.74 C1(O)C=CC(/C=C(\C(OCCCCCCC)=O)/C(=O)OCCCCCCC)=CC=1
MCULE-5234076176 0.74 CCOC(C=CC1=CC(OC)=C(OCC)C=C1)=O
MCULE-3422343269 0.74 C1(=CC=C(C=C1)/C=C(\C(=O)OCCCCCCCCCCCCCCCC)/C(=O)OCCCCCCCCCCCCCCCC)O
MCULE-3338686878 0.74 C(OCCC1=CC=CC=C1)(=O)/C=C/C1=CC=C(OC)C(O)=C1
MCULE-1276820530 0.74 C12(C)CCC3C4(CCCCC4(CCC3C1CCC2OC(=O)C=CC1C=CC=CC=1)[H])C
MCULE-5875790475 0.74 C1(=C/C2C=CC(=C(OC)C=2)O)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-1938722753 0.74 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)OCCCCCC
MCULE-4801868681 0.74 CCOC1=CC=C(C=CC(OC2CC(C#N)CC2)=O)C=C1
MCULE-5169610903 0.74 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCCC
MCULE-8054733396 0.74 CCCOC1=C(OC)C=C(C=CC(OCC)=O)C=C1
MCULE-5757199598 0.74 C1(O)C=C(/C=C/C(=O)OC)C=CC=1OC
MCULE-7533572392 0.74 C(=CC1C=CC(=C(O)C=1)OC)C(OC)=O
MCULE-1174854441 0.74 COC1=C(OC)C=C(C=CC(OCC#N)=O)C=C1
MCULE-7614619109 0.74 C(OC(C)C)(=O)C=CC1C=CC=C(C=1)OC1C=CC=CC=1
MCULE-2906396849 0.74 O=C(/C=C/C1C=C(OC)C(O)=C(OC)C=1)OC
MCULE-3544192829 0.74 COC1=C(O)C=CC(C=C(C(OC(C)C)=O)C#N)=C1
MCULE-1103995074 0.74 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)O
MCULE-3276408573 0.74 C(/C(=O)OCC)(\C(=O)OCC)=C\C1=CC=C(OC)C(OC)=C1
MCULE-9182535950 0.74 C(=CC1C=CC(=C(OCC)C=1)OCCCC)C(OC)=O
MolPort-005-264-349 0.73 OC(=O)C=Cc1cccc(OC2CCCCC2)c1
MolPort-002-047-337 0.73 CCCCCOc1ccc(\C=C\C(O)=O)cc1OC
MolPort-020-392-495 0.73 OC1C[C@](O)(CC(OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O
MolPort-002-329-119 0.73 COc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1OC
MolPort-002-530-492 0.73 O[C@H]1C[C@@](O)(C[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)C(O)=O
MolPort-005-945-318 0.73 COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-009-674-534 0.73 OC1CC(O)(CC(OC(=O)C=Cc2ccc(O)c(O)c2)C1O)C(O)=O
MolPort-001-759-169 0.73 OC1CC(O)(CC(OC(=O)\C=C\c2ccc(O)c(O)c2)C1O)C(O)=O
MolPort-001-740-212 0.73 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O
MolPort-000-672-257 0.73 CCCCCCOc1ccc(\C=C\C(=O)Oc2ccccc2OCC)cc1OC
MolPort-020-358-127 0.73 OC(=O)\C=C\c1cccc(OC2CCCCC2)c1
MolPort-039-063-547 0.73 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)c(O)c6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-044-275-415 0.73 FC(F)Oc1ccc(C=CC(=O)OCC(=O)C23CC4CC(CC(C4)C2)C3)cc1
MolPort-044-212-300 0.73 COc1ccc(C=CC(=O)OCCCC(=O)c2ccc(Br)cc2)cc1OC
MolPort-046-153-072 0.73 COc1cc(\C=C\C(=O)OC(C(O)C(OC(=O)\C=C\c2ccc(O)c(OC)c2)C(O)=O)C(O)C(O)=O)ccc1O
MolPort-001-740-201 0.73 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)C(O)=O
MolPort-046-701-378 0.73 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H]1O)C(O)=O
MolPort-035-394-873 0.73 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1O)C(O)=O
MolPort-046-790-533 0.73 COC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MCULE-4077827006 0.73 OC(C=CC1=CC(OC2CCCCC2)=CC=C1)=O
MCULE-7815011628 0.73 CCOC(C=CC1=CC(OCC)=C(OCC)C=C1)=O
MCULE-8793591909 0.73 C(OC(C)C)(=O)C=CC1=CC=CC(OCC)=C1
MCULE-1325921732 0.73 C1(C=CC(/C=C(\C(=O)OCCCCCC)/C(=O)OCCCCCC)=CC=1)O
MCULE-6867995492 0.73 C(O)(=O)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-3982495166 0.73 COC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-4290798755 0.73 COC1=C(OC)C=C(C=CC(OCCCC(C2=CC=C(Br)C=C2)=O)=O)C=C1
MCULE-6106371004 0.73 C(=O)(O)C(O)C(OC(/C=C/C1C=CC(O)=C(OC)C=1)=O)C(O)C(OC(/C=C/C1C=C(OC)C(O)=CC=1)=O)C(=O)O
MCULE-9853532211 0.73 C1(=C/C2=CC=C(C(OC)=C2)OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-6487131081 0.73 C1(O)=C(C=CC(=C1)C=CC(O[C@@H]1C[C@](C(=O)O)(O)C[C@@H](O)[C@@H]1O)=O)O
MCULE-8331698684 0.73 [C@]1(O)(C(O)=O)C[C@@H](O)[C@H]([C@H](OC(=O)C=CC2C=CC(=C(O)C=2)O)C1)O
MCULE-1539064371 0.73 C1[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]([C@@H]1OC(=O)/C=C/C1C=C(O)C(O)=CC=1)O
MCULE-9114428191 0.73 O=C(O)[C@@]1(C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C\C2C=C(O)C(O)=CC=2)C1)O
MCULE-8135887819 0.73 C1[C@@](C[C@H]([C@@H]([C@@H]1O)O)OC(/C=C/C1C=C(O)C(O)=CC=1)=O)(O)C(=O)O
MCULE-2315764400 0.73 C1(O)CC(O)(C(O)=O)CC(OC(C=CC2=CC=C(O)C(O)=C2)=O)C1O
MCULE-5206740806 0.73 C(=O)(C=CC1=CC=C(C(OC)=C1)OCCCCCC)OC1=CC=CC=C1OCC
MCULE-6384786021 0.73 [C@H]1(C[C@@](C(=O)OC)(C[C@@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@@H]1O)O)O
MCULE-5282788280 0.73 [C@]1(O)(C(O)=O)C[C@@H](O)[C@H]([C@H](OC(=O)C=CC2C=CC(=C(O)C=2)O)C1)O
MCULE-7970737031 0.73 [C@@]1(O)(C(O)=O)C[C@H](O)[C@@H]([C@@H](OC(=O)C=CC2C=CC(=C(O)C=2)O)C1)O
MCULE-5301588795 0.73 C(=CC1C=CC=C(C=1)OC1C=CC=CC=1)C(OCC)=O
MolPort-001-834-013 0.72 CCOC(=O)C(=Cc1ccc(OC)c(OC)c1)C#N
MolPort-000-902-704 0.72 CCOC(=O)C(=C\c1ccc2OCOc2c1)\C(C)=O
MolPort-001-928-322 0.72 CCOC(=O)C(=C/c1ccc2OCOc2c1)\C(C)=O
MolPort-001-820-309 0.72 COc1cc(\C=C2/COC\C(=C/c3ccc(O)c(OC)c3)C2=O)ccc1O
MolPort-007-981-036 0.72 COC(=O)\C=C\c1ccc(OCC(C)C)c(OC)c1
MolPort-001-740-184 0.72 O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-000-902-350 0.72 CCOC(=O)C(=C\c1ccc(OC)c(OC)c1)\C#N
MolPort-000-157-638 0.72 COC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
MolPort-002-048-137 0.72 CCOC(=O)C(=C/c1ccc(OC)c(OC)c1)\C#N
MolPort-001-740-224 0.72 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-001-740-223 0.72 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-009-345-919 0.72 CCCCCOC(=O)C=Cc1ccccc1
MolPort-011-018-530 0.72 COc1cc(C=CC(O)=O)ccc1O
MolPort-000-490-395 0.72 COc1cc(\C=C\C(O)=O)ccc1O
MolPort-002-524-339 0.72 CC1(C)CC[C@@]23CO[C@@H]1[C@H]2[C@]1(C)CCC2[C@@]4(C)CC[C@@H](OC(=O)\C=C\c5ccccc5)C(C)(C)C4CC[C@@]2(C)[C@@H]1CC3
MolPort-002-329-105 0.72 COc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1O
MolPort-003-741-923 0.72 COc1ccc(\C=C(/C)C(O)=O)cc1OC
MolPort-044-208-462 0.72 COc1cc(C=CC(=O)OCCCC(=O)c2ccccc2)ccc1OCC#N
MolPort-044-207-048 0.72 CCOc1ccc(C=CC(=O)OC)cc1OC
MolPort-046-596-582 0.72 CC1(C)CCC23COC1C2C1CCC2[C@@]4(C)CCC(OC(=O)\C=C\c5ccccc5)C(C)(C)C4CC[C@@]2(C)[C@]1(C)CC3
MolPort-027-637-461 0.72 COC(=O)\C=C\c1cccc(OC)c1
MolPort-046-594-194 0.72 OC1CC(O)(CC(OC(=O)C=Cc2ccc(O)c(O)c2)C1OC(=O)C=Cc1ccc(O)c(O)c1)C(O)=O
MolPort-044-754-066 0.72 COC(=O)[C@]1(O)C[C@@H](O)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-042-675-497 0.72 COC(=O)[C@@]1(O)C[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-046-196-127 0.72 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H]1OC(=O)C=Cc1ccc(O)c(O)c1)C(O)=O
MolPort-044-296-974 0.72 Cl.COc1ccc(C=CC(=O)OC2CCCCC2CN(C)C)cc1
MolPort-044-723-799 0.72 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1OC(=O)C=Cc1ccc(O)c(O)c1)C(O)=O
MolPort-046-417-438 0.72 OC1C(CC(O)(CC1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-046-703-128 0.72 CO[C@]1(CC[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@@H]1O)C(O)=O
MolPort-044-754-067 0.72 COC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-046-687-449 0.72 CCOC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-044-830-432 0.72 OC1[C@@H](CC(O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-020-018-488 0.72 CC(OC(=O)C=Cc1ccc2OCOc2c1)C(C)=O
MolPort-044-295-613 0.72 CC(C)OC(=O)C(=Cc1ccc2OCOc2c1)C(C)=O
MCULE-8442047802 0.72 C(O)(=O)/C=C/C1=CC=C(C(OC)=C1)O
MCULE-4654914094 0.72 CCCCCOC(C=CC1=CC=CC=C1)=O
MCULE-6127598109 0.72 C(O)(=O)C=CC1=CC=C(C(OC)=C1)O
MCULE-7171633777 0.72 COC1=CC=C(C=CC(OC2C(CN(C)C)CCCC2)=O)C=C1
MCULE-9394957877 0.72 C(=CC1C=CC=C(OC)C=1)C(OC)=O
MCULE-5107771934 0.72 C(C#N)(=CC1C=C(OC)C(OC)=CC=1)C(OCC(C)C)=O
MCULE-3283632849 0.72 C(C)(C(O)=O)=CC1C=CC(=C(OC)C=1)OC
MCULE-3650380761 0.72 C1[C@@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@H](O)C[C@@]1(C(=O)O)O
MCULE-2405701270 0.72 C1[C@](C[C@H]([C@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@@H]1O)OC(=O)/C=C/C1C=C(O)C(O)=CC=1)(C(=O)O)O
MCULE-4558935979 0.72 C1[C@@](O)(C(=O)OC)C[C@@H](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)[C@H](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)[C@@H]1O
MCULE-6018931477 0.72 C1C(O)(C(O)=O)CC(OC(C=CC2C=CC(O)=C(O)C=2)=O)C(OC(C=CC2C=CC(O)=C(O)C=2)=O)C1O
MCULE-3400598023 0.72 C(=CC1=CC=CC(OCC)=C1)C(OCC)=O
MCULE-7594324899 0.72 C1[C@](C(=O)OC)(O)C[C@@H](O)[C@H](OC(/C=C/C2C=CC(O)=C(O)C=2)=O)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(O)C=1
MCULE-2635091853 0.72 C1(O)=C(O)C=CC(C=CC(=O)O[C@H]2[C@H](O)C[C@](O)(C(=O)O)C[C@H]2OC(=O)C=CC2C=CC(O)=C(O)C=2)=C1
MCULE-4847144090 0.72 C1[C@@H](O)[C@@H](OC(C=CC2C=CC(O)=C(O)C=2)=O)[C@H](OC(=O)C=CC2C=CC(O)=C(O)C=2)C[C@@]1(C(O)=O)O
MCULE-8435564843 0.72 CCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-3421702175 0.72 C1(OC)=C(OC)C(=CC(/C=C/C(=O)OC)=C1)OC
MCULE-6770320666 0.72 C1(OC)=C(OC)C=C(C=C1OC)C=CC(OC)=O
MCULE-5940157990 0.72 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)OC
MCULE-8141098320 0.72 OC1C=CC(/C(=C(/C(=O)O[C@]2([C@@H](O)[C@]([H])(OC(=O)/C(=C(/C3C=CC(O)=C(O)C=3)\[H])/[H])C[C@](O)(C(=O)O)C2)C)\[H])/[H])=CC=1O
MCULE-7914913444 0.72 C1[C@@](O)(C(=O)OC)C[C@@H](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)[C@H](O)[C@@H]1OC(=O)/C=C/C1C=C(O)C(O)=CC=1
MCULE-3995347864 0.72 [C@@H]1(OC(=O)C=CC2C=CC(O)=C(O)C=2)C[C@](C[C@@H](OC(=O)C=CC2=CC=C(O)C(O)=C2)[C@H]1O)(O)C(=O)O
MCULE-3597017072 0.72 OC1C=CC(C(=C(C(=O)O[C@]2([C@@H](O)[C@]([H])(OC(=O)C(=C(C3C=CC(O)=C(O)C=3)[H])[H])C[C@](O)(C(=O)O)C2)C)[H])[H])=CC=1O
MCULE-8096920379 0.72 C1[C@@](O)(C(O)=O)C[C@@H](OC(=O)/C=C/C2=CC=C(O)C(O)=C2)[C@@H]([C@@H]1OC(=O)/C=C/C1C=C(O)C(O)=CC=1)O
MCULE-6455641873 0.72 C1(O)(C(O)=O)CC(OC(=O)/C=C/C2=CC=C(O)C(O)=C2)C(O)C(OC(=O)/C=C/C2=CC=C(O)C(O)=C2)C1
MCULE-2852384973 0.72 C(=CC1=CC=C(C(OC)=C1)OCC(C)C)C(OC)=O
MCULE-1766189090 0.72 C(=CC1=CC=C(C(OC)=C1)OCCC)C(OC)=O
MCULE-3579003125 0.72 CC(C(C)=O)OC(C=CC1=CC2=C(OCO2)C=C1)=O
MCULE-2161225059 0.72 C1(OC2CCCC2)C=C(C=CC=1OC)C=CC(=O)O
MCULE-4428935482 0.72 CC(OC(C(C(C)=O)=CC1=CC2=C(OCO2)C=C1)=O)C
MCULE-7639850434 0.72 Cl.COC1=CC=C(C=CC(OC2C(CN(C)C)CCCC2)=O)C=C1
MCULE-9859064485 0.72 C(C(C)=O)(C(OCC)=O)=CC1C=CC2=C(OCO2)C=1
MCULE-4694484353 0.72 C1(COCC(=CC2C=CC(O)=C(OC)C=2)C1=O)=CC1=CC=C(O)C(OC)=C1
MCULE-9120269038 0.72 C1=C(O)C=CC(C=C(C#N)C(=O)OCCCCCC)=C1
MCULE-7983545232 0.72 CC(C(=CC1C=C2OCOC2=CC=1)C(OC(C)(C)C)=O)=O
MCULE-3926693155 0.72 C1(=C/C2C=CC(=C(O)C=2)OC)\C(=O)OC2(OC\1=O)CCCCC2
MCULE-5000525283 0.72 COC1=C(OCC#N)C=CC(C=CC(OCCCC(C2=CC=CC=C2)=O)=O)=C1
MCULE-4584141597 0.71 C1(CC(OC1=O)C)=CC1C=C(OC)C(=C(OC)C=1)OC
MCULE-9732905063 0.71 OC(C=CC1=CC(OC2CCCC2)=CC=C1)=O
MCULE-7383875383 0.71 C(=C/C1=CC=C(C=C1)O)(\C(OCCCCCCCCCC=C)=O)/C(OCCCCCCCCCC=C)=O
MCULE-1562931521 0.71 CCOC1=C(OCC)C=C(C=CC(OC)=O)C=C1
MCULE-2639296166 0.71 C1(O)C(O)=CC(C=CC(OCC)=O)=CC=1
MCULE-6271208728 0.71 C1(O)C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-6140852587 0.71 C1(C=CC(/C=C(\C(=O)OCCCCC)/C(OCCCCC)=O)=CC=1)O
MCULE-4995102542 0.71 C(C#N)(C(OC)=O)=CC1C=CC(=C(OC)C=1)O
MCULE-2482402150 0.71 CCOC(C=CC1=CC2=C(OCO2)C=C1)=O
MCULE-4579508157 0.71 COC1=C(O)C=CC(C=CC(OCC(C2=CC=CC=C2)=O)=O)=C1
MCULE-8844361851 0.71 C1(=C/C2C=CC(=C(OC)C=2)OC)\C(=O)OC2(OC\1=O)CCCC2
MCULE-2062887172 0.71 C/C(/C(O)=O)=C\C1C=C(OC2CCCC2)C(OC)=CC=1
MCULE-1773252539 0.71 COC1=CC=C(C=C(C)C(O)=O)C=C1OC1CCCC1
MCULE-7665010303 0.71 C(O)(=O)C=CC1C=CC(=CC=1)OCCCCCCCCCCCC
MCULE-5665968659 0.71 C(O)(=O)C=CC1C=CC(OCCCCCCC)=CC=1
MCULE-3749639373 0.71 C(O)(=O)C=CC1=CC=C(C=C1)OCCCCCCCC
MCULE-7809972771 0.71 C(OC(C)C)(=O)C=CC1C=CC(=CC=1)OCCCC
MCULE-3680174639 0.71 C(O)(=O)C=CC1C=CC(=CC=1)OCCCCCCCCCC
MCULE-8549715639 0.71 C(=CC1C=CC(=CC=1)OCCCC)C(OCC)=O
MCULE-4174430828 0.71 C(O)(=O)C=CC1C=CC(OCCCCCCCCC)=CC=1
MCULE-4648711215 0.71 C1=C(OC)C(OC)=CC(/C=C/C(=O)O)=C1
MCULE-5134512966 0.71 C(O)(=O)C=CC1C=CC(=C(OC)C=1)OC
MolPort-044-650-416 0.71 O=C(OCC1CCC1)\C=C\c1ccccc1
MolPort-019-994-566 0.71 [Na+].COc1cc(C=CC([O-])=O)ccc1O
MolPort-044-380-764 0.71 COc1cc(C=CC(=O)OCCCOC(=O)C=Cc2ccc(OC(F)F)c(OC)c2)ccc1OC(F)F
MolPort-044-723-706 0.71 CCOC(=O)C=Cc1ccc(O)c(O)c1
MolPort-039-063-556 0.71 COc1cc(\C=C\C(=O)OC\C=C(/C)CCC=C(C)C)ccc1O
MolPort-001-017-639 0.71 COC(=O)C(=C\c1ccc(O)c(OC)c1)\C#N
MolPort-044-227-463 0.71 COc1cc(C=CC(=O)OCC(=O)c2ccccc2)ccc1O
MolPort-044-376-563 0.71 COC(=O)C(=Cc1ccc(O)c(OC)c1)C#N
MolPort-046-590-821 0.71 COc1ccc(\C=C(/C)C(O)=O)cc1OC1CCCC1
MolPort-044-214-359 0.71 O=C(COC(=O)C(=Cc1ccc2OCOc2c1)C#N)C12CC3CC(CC(C3)C1)C2
MolPort-001-741-601 0.71 OC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-004-288-306 0.71 COc1ccc(C=CC(O)=O)cc1OC
MolPort-003-846-822 0.71 COc1ccc(cc1OC)\[13CH]=[13CH]\[13C](O)=O
MolPort-000-489-707 0.71 COc1ccc(\C=C\C(O)=O)cc1OC
MolPort-002-857-369 0.71 CCCCCCCCCCOc1ccc(\C=C/C(O)=O)cc1
MolPort-000-420-148 0.71 CCCCCCCCOc1ccc(\C=C\C(O)=O)cc1
MolPort-002-329-140 0.71 COc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1OC
MolPort-044-222-662 0.71 CCC(CC#N)OC(=O)C=Cc1ccc2OCOc2c1
MolPort-009-796-044 0.71 CCOC(=O)C=Cc1ccc2OCOc2c1
MolPort-000-746-614 0.71 CCOC(=O)C(=Cc1ccc(OCCCCCCCCCCOc2ccc(C=C(C(=O)OCC)C(=O)OCC)cc2)cc1)C(=O)OCC
MolPort-000-860-998 0.71 CCOC(=O)\C=C\c1ccc2OCOc2c1
MolPort-000-750-270 0.71 CCOC(=O)C(=Cc1ccc(OCCCCCCCOc2ccc(C=C(C(=O)OCC)C(=O)OCC)cc2)cc1)C(=O)OCC
MolPort-003-986-654 0.71 [Na+].COc1cc(\C=C\C([O-])=O)ccc1O
MolPort-000-751-399 0.71 CCOC(=O)C(=Cc1ccc(OCCCCCCCCOc2ccc(C=C(C(=O)OCC)C(=O)OCC)cc2)cc1)C(=O)OCC
MolPort-001-671-444 0.71 CCOC(=O)C(=Cc1ccc(OCCCCCCCCCOc2ccc(C=C(C(=O)OCC)C(=O)OCC)cc2)cc1)C(=O)OCC
MolPort-000-651-659 0.71 CCCCCOc1ccc(\C=C\C(=O)Oc2ccc(OC)cc2)cc1OC
MolPort-002-842-498 0.71 COc1cc(\C=C2/CC(C)OC2=O)cc(OC)c1OC
MolPort-009-291-711 0.71 OC(=O)C=Cc1cccc(OC2CCCC2)c1
MolPort-007-992-515 0.71 OC(=O)\C=C\c1cccc(OC2CCCC2)c1
MolPort-004-787-195 0.71 CCOC(=O)\C=C\c1ccc(O)c(O)c1
MCULE-3139903813 0.71 C(=C/C1=CC=C(C=C1)OCCCCCCCCCOC1C=CC(=CC=1)/C=C(\C(OCC)=O)/C(OCC)=O)(\C(OCC)=O)/C(OCC)=O
MCULE-3526268302 0.71 O=C(C=CC1=CC=CC=C1)OCC1CCC1
MCULE-4835318973 0.71 C(=C/C1C=CC(=CC=1)OCCCCCCCOC1=CC=C(C=C1)/C=C(\C(OCC)=O)/C(OCC)=O)(\C(OCC)=O)/C(OCC)=O
MCULE-8689041474 0.71 COC1=C(OC(F)F)C=CC(C=CC(OCCCOC(C=CC2=CC(OC)=C(OC(F)F)C=C2)=O)=O)=C1
MCULE-5476569550 0.71 [Na+].COC1C=C(/C=C/C(=O)[O-])C=CC=1O
MCULE-5483206343 0.71 C(=C/C1=CC=C(C=C1)OCCCCCCCCOC1C=CC(=CC=1)/C=C(/C(OCC)=O)\C(OCC)=O)(\C(OCC)=O)/C(OCC)=O
MCULE-3367833823 0.71 O(C(/C=C/C1C=C(C(O)=CC=1)O)=O)[C@@H]1C[C@@](C(=O)O)(O)C[C@@H](OC(=O)/C=C/C2=CC=C(O)C(O)=C2)[C@H]1OC(=O)/C=C/C1=CC=C(O)C(O)=C1
MCULE-9094428143 0.71 [Na+].C([O-])(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-5978300592 0.71 C(=C/C1C=CC(=CC=1)OCCCCCCCCCCOC1=CC=C(C=C1)/C=C(/C(OCC)=O)\C(OCC)=O)(/C(OCC)=O)\C(OCC)=O
MCULE-7156627129 0.71 CCC(OC(C=CC1=CC2=C(OCO2)C=C1)=O)CC#N
MCULE-4586606154 0.71 C(=O)(OC1C=CC(=CC=1)OC)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-5289107821 0.71 C(OCC)(C=CC1=CC(OC)=CC(OC)=C1)=O
MCULE-3205633243 0.70 [N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1=CC=CC(OC)=C1OC)C
MCULE-8567722249 0.70 N12CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1=CC=CC(OC)=C1OC
MCULE-8902366584 0.70 C(C#N)(C(OCC)=O)=CC1=CC=C(C(O)=C1)OC
MCULE-6594644394 0.70 [C@]1(OC(=O)/C=C/C2=CC=C(O)C(O)=C2)(C(O)=O)C[C@H](O)[C@@H](OC(=O)/C=C/C2=CC=C(O)C(O)=C2)[C@@H](O)C1
MCULE-8186529318 0.70 C1[C@@](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)(C(=O)O)C[C@@H](O)[C@H](OC(=O)/C=C/C2C=C(O)C(O)=CC=2)[C@@H]1O
MCULE-1563762406 0.70 [N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC(OC)=CC=1)C
MCULE-4269137017 0.70 CNC1(CCOCC1)CCOC(C=CC1=CC(OC)=C(F)C=C1)=O
MCULE-1063522507 0.70 N12CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC(=CC=1)OC
MCULE-2696133489 0.70 C1[C@@](OC(/C=C/C2C=CC(O)=C(O)C=2)=O)(C(=O)O)C[C@H]([C@@H]([C@@H]1O)O)O
MCULE-1179853599 0.70 COC1=CC(C=C(C2=CC=CC=C2)C(OC2C(=O)CCCC2)=O)=CC=C1
MCULE-1430454137 0.70 COC1=C(O)C(OC)=CC(C=C(C(OC(C)C)=O)C#N)=C1
MCULE-1988786322 0.70 C1=CC(=CC=C1/C=C/C(O[C@H]1[C@@H](C[C@](C[C@H]1O)(O)C(O)=O)O)=O)O
MCULE-4385786486 0.70 C(=C/C1=CC=C(C=C1)OCCCCCCOC1C=CC(=CC=1)/C=C(/C(OCC)=O)\C(OCC)=O)(\C(OCC)=O)/C(OCC)=O
MCULE-1787414297 0.70 C1(OC)C(OC)=CC(/C=C(\C(=O)OCC)/C(=O)OCC)=CC=1OC
MCULE-1769125783 0.70 C1(=C/C2C=C(OC)C(=C(OC)C=2)OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-4474652685 0.70 COC1=C(O)C=CC(C=CC(OCC2=CC=C(COC(C=CC3=CC(OC)=C(O)C=C3)=O)C=C2)=O)=C1
MCULE-2397633711 0.70 C1(=C/C2C=CC(=C(OC)C=2)OCC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-2850743429 0.70 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCC1C=CC=CC=1
MCULE-7843780897 0.70 COC1=C(O)C=C(C=C(C(OCC=C)=O)C#N)C=C1
MCULE-2527166131 0.70 C(=CC1C=CC=C(C=1)OC1=CC=CC=C1)C(OC)=O
MCULE-3555439277 0.70 FC(OC1=CC=C(C=CC(OC2C(=O)CCC2)=O)C=C1)F
MCULE-4818243200 0.70 C12C(C(=C)C)CCC1(COC(=O)C=CC1=CC=CC=C1)CCC1(C)C3(C)CCC4C(C)(C)C(CCC4(C)C3CCC21)O
MCULE-7275281747 0.70 C(CC(O)=O)(C(OC)=O)=CC1=CC=C(OC)C(OC)=C1
MCULE-2501351206 0.70 C1(OC)C(OC)=CC=C(/C=C(/C(=O)OC)\CC(O)=O)C=1
MCULE-6362643421 0.70 C1(C=CC(=O)OCCCCCCCCCCCCCCCC)=CC=C(C=O)C=C1
MCULE-9466246282 0.70 C12(COC(=O)C=CC3=CC=CC=C3)CCC(C(=C)C)C1C1CCC3C4(C)CCC(OC(=O)C=CC5C=CC=CC=5)C(C)(C)C4CCC3(C)C1(CC2)C
MCULE-5634312752 0.70 [I-].[N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1=CC=CC(OC)=C1OC)C
MCULE-7916534392 0.70 CCCCOC1=C(OC)C=C(C=CC(O)=O)C=C1
MCULE-7134294771 0.70 C(O)(=O)C=CC1C=CC(=C(OC)C=1)OCCC(C)C
MCULE-4703231653 0.70 COC1=C(OC)C=C(C=CC(OC2C(=O)OCC2)=O)C=C1
MCULE-2986861704 0.70 C1(C=CC(OC)=CC=1)C=C(C(=O)C)C(=O)OCC
MCULE-3824890168 0.70 [I-].[N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC(OC)=CC=1)C
MCULE-7930711528 0.70 C(C#N)(=CC1C=CC(=CC=1)OC)C(OCCCC)=O
MCULE-3361523073 0.70 O=C(O)[C@]1(C[C@@H](O)[C@H](CC(=O)C=CC2C=C(O)C(O)=CC=2)[C@H](OC(=O)C=CC2C=C(O)C(O)=CC=2)C1)C
MCULE-4113907065 0.70 C(=CC1=CC=CC(OCC)=C1)C(OC)=O
MCULE-7687875058 0.70 C1(=C/C2=CC=C(C(O)=C2)OC)/C(=O)OC2(OC/1=O)CCCC2
MCULE-8479681560 0.70 COC(C=CC1=CC(OC)=C(OCC(C(C)(C)C)=O)C=C1)=O
MCULE-9662330987 0.70 C(O)(=O)C=CC1C=CC(=CC=1)OCCCCCC
MCULE-2098552747 0.70 C(O)(=O)C=CC1C=CC(OCCCCCCO)=CC=1
MolPort-000-792-704 0.70 CC(=C)C1CCC2(COC(=O)\C=C\c3ccccc3)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC34C)C12
MolPort-009-167-858 0.70 COC(=O)C=Cc1ccc(OCC(=O)C(C)(C)C)c(OC)c1
MolPort-002-329-133 0.70 COc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1O
MolPort-000-744-208 0.70 [I-].COc1ccc(\C=C\C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)cc1
MolPort-000-490-672 0.70 CCCCOc1ccc(\C=C\C(O)=O)cc1OC
MolPort-002-192-061 0.70 CCCCC1(C)OC(=O)C(=Cc2ccc(OCC)c(OC)c2)C(=O)O1
MolPort-000-731-235 0.70 [I-].COc1cccc(\C=C\C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)c1OC
MolPort-000-795-014 0.70 CCCCC1(C)OC(=O)C(=Cc2cc(OC)c(OC)c(OC)c2)C(=O)O1
MolPort-002-329-120 0.70 CCOc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1OC
MolPort-000-772-436 0.70 CC(=C)C1CCC2(COC(=O)\C=C\c3ccccc3)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(OC(=O)\C=C\c6ccccc6)C(C)(C)C5CC[C@@]34C)C12
MolPort-002-511-960 0.70 CC(=C)C1CCC2(COC(=O)\C=C\c3ccccc3)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
MolPort-006-827-355 0.70 COC(=O)C(\CC(O)=O)=C\c1ccc(OC)c(OC)c1
MolPort-002-833-239 0.70 COc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc(OC)c1OC
MolPort-001-740-251 0.70 O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)cc1)C(O)=O
MolPort-002-916-131 0.70 CCOC(=O)C(=Cc1cc(OC)c(OC)c(OC)c1)C(=O)OCC
MolPort-001-740-811 0.70 O[C@@H]1C[C@](C[C@@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-001-740-231 0.70 O[C@@H]1C[C@](C[C@@H](O)[C@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-000-744-490 0.70 COc1ccc(\C=C\C(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1
MolPort-002-513-614 0.70 COc1cccc(\C=C\C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)c1OC
MolPort-000-725-028 0.70 COc1cccc(\C=C\C(=O)OC[C@@H]2CCCN3CCCC[C@H]23)c1OC
MolPort-001-944-547 0.70 CCOC(=O)C(=C/c1ccc(OC)c(O)c1)\C#N
MolPort-002-513-480 0.70 COc1ccc(\C=C\C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)cc1
MolPort-044-222-189 0.70 CNC1(CCOC(=O)C=Cc2ccc(F)c(OC)c2)CCOCC1
MolPort-044-228-697 0.70 COc1cc(C=C(C#N)C(=O)OC(C)C)cc(OC)c1O
MolPort-044-227-511 0.70 COc1cc(C=CC(=O)OCc2ccc(COC(=O)C=Cc3ccc(O)c(OC)c3)cc2)ccc1O
MolPort-044-400-066 0.70 COc1ccc(C=C(C#N)C(=O)OCC=C)cc1O
MolPort-044-275-432 0.70 FC(F)Oc1ccc(C=CC(=O)OC2CCCC2=O)cc1
MolPort-044-212-294 0.70 COc1ccc(C=CC(=O)OC2CCOC2=O)cc1OC
MolPort-023-331-239 0.70 C[C@@]1(C[C@@H](O)[C@H](CC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-044-215-245 0.70 COc1cccc(C=C(C(=O)OC2CCCCC2=O)c2ccccc2)c1
MCULE-8064464660 0.69 C1(OC)C=C(/C=C/C(=O)OC[C@@H](O)C2C=CC(O)=CC=2)C=CC=1O
MCULE-7114836271 0.69 COC1=C(OC)C=C(C=CC(OCC(C2=CC=CC=C2)=O)=O)C=C1
MCULE-5892286449 0.69 C(OCCC1=CC=CC=C1)(=O)/C=C/C1=CC=C(O)C(O)=C1
MCULE-4178365007 0.69 C(OCCC1=CC=CC=C1)(=O)C=CC1=CC=C(O)C(O)=C1
MCULE-4303741744 0.69 CC(CCCCOC(C=CC1=CC2=C(OCCO2)C(Cl)=C1)=O)=O
MCULE-3256224087 0.69 C1(=C/C2=CC=C3C(OCO3)=C2)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-9833802426 0.69 C1(=C/C2C=CC(=C(OCC)C=2)OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-3982554378 0.69 COC1=C(OC)C=C(C=CC(OCC2=CC=CC=C2)=O)C=C1
MCULE-4909218007 0.69 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OC
MCULE-6520556044 0.69 COC1=C(O)C=CC(C=CC(OCCOC2=CC=CC=C2)=O)=C1
MCULE-9094115086 0.69 C(C)(=O)OC1C(=CC2C=CC(OC)=CC=2)CC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC2(C1)[H]
MCULE-5833870520 0.69 O(C(/C=C/C1C=CC(=C(C=1)O)O)=O)CC(C(C(=O)O)(C)O)O
MCULE-6527164164 0.69 C(OC(C)C)(=O)C=CC1C=CC(=C(OCC)C=1)OCC1C=CC=CC=1
MCULE-2436289859 0.69 COC1=C(OCC#N)C=CC(C=CC(OC(C#N)C)=O)=C1
MCULE-2909537642 0.69 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OCCOC1=CC=C(C=C1)OCCCCCC
MCULE-6090682719 0.69 COC1=C(OC)C=C(C=CC(OC(C2=CC=CC=C2)C)=O)C=C1
MCULE-3823662949 0.69 COC1=C(O)C=CC(C=CC(OC(C(C2=CC=CC=C2)=O)C)=O)=C1
MCULE-5923337066 0.69 [C@]1(OC(=O)C=CC2=CC=C(O)C(O)=C2)(C(O)=O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)C=CC2C=CC(O)=C(O)C=2)C1
MCULE-1813453592 0.69 C1[C@@](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)(C(=O)O)C[C@@H](O)[C@H](O)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(O)C=1
MCULE-1204488900 0.69 O[C@@H]1[C@H](OC(/C=C/C2=CC=C(O)C(O)=C2)=O)C[C@](C(=O)O)(OC(/C=C/C2=CC=C(O)C(O)=C2)=O)C[C@H]1OC(/C=C/C1=CC=C(O)C(O)=C1)=O
MCULE-7490495386 0.69 C1[C@@](OC(/C=C/C2C=CC(O)=C(O)C=2)=O)(C(=O)O)C[C@H]([C@@H]([C@@H]1O)O)OC(/C=C/C1C=C(O)C(O)=CC=1)=O
MCULE-3401905492 0.69 C(O)(=O)C=CC1C=CC(=C(OCC)C=1)OCCCC
MCULE-6632321964 0.69 C(OCC)(C=CC1=CC=C(OCC2C=CC=CC=2)C(OC)=C1)=O
MCULE-9348326502 0.69 C(=O)(OC1=CC=C(C=C1)OCCCCCCCC)C=CC1C=CC(=CC=1)OC
MCULE-8569494275 0.69 O(CC1=CC=CC=C1)C1=CC=C(/C=C/C(=O)OCC)C=C1OC
MCULE-7539638665 0.69 CCOC(C=CC1=CC=C(OC)C=C1)=O
MCULE-4571364221 0.69 COC1=C(O)C=C(C=CC(O)=O)C=C1
MCULE-7013523945 0.69 C1=C(OC)C(O)=CC(=C1)/C=C/C(=O)O
MCULE-4680058595 0.69 COC1=CC(C=C(C(O)=O)C)=CC=C1
MCULE-3659493926 0.69 C1C=C(/C=C/C(=O)OCC)C=CC=1OC
MCULE-3061501851 0.69 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OC(C1CCCCC1)=O
MCULE-6413619977 0.69 C1(OC)=C(OC)C=C(C=C(C#N)C(=O)OCC)C=C1OC
MCULE-1335506941 0.69 COC1C(O)=C(OC)C=C(/C=C/C(=O)O)C=1
MCULE-6112659813 0.69 COC1=C(O)C(OC)=CC(C=CC(O)=O)=C1
MCULE-5670575737 0.69 COC1=CC=C(C(COC(C=CC2=CC(OC)=C(O)C=C2)=O)=O)C=C1
MCULE-5002365431 0.69 CCC1=CC=C(C(COC(C=CC2=CC(OC)=C(O)C=C2)=O)=O)C=C1
MCULE-4305805410 0.69 C(OC)(C=CC1C=C(OC)C=C(OC)C=1)=O
MCULE-7299797478 0.69 C(CC(=O)O)(C(=O)OCC)=C(C)C1=CC=CC(OC)=C1
MCULE-4807121652 0.69 C1(O)=C(C)C=C(C=C1OC)C([H])=C([H])C(O)=O
MCULE-5655529420 0.69 C1C=C(C=C(C)C(=O)O)C=C(OC)C=1OC(C)C
MCULE-2560342671 0.69 C12C=C(C=CC=1OCO2)C=CC(OC)=O
MCULE-3047237533 0.69 COC(C=CC1=CC(OC)=C(OCCO)C=C1)=O
MCULE-4723206748 0.69 C(/C(OCC)=O)(\C(OCC)=O)=C\C1C=CC=C(C=1)OC1=CC=CC=C1
MCULE-4578628689 0.69 COC1=C(OC)C=C(C=CC(OCC2=CC=C(COC(C=CC3=CC(OC)=C(OC)C=C3)=O)C=C2)=O)C=C1
MCULE-5099557032 0.69 COC1=C(O)C=CC(C=CC(OCCOC2=CC=C(C)C=C2)=O)=C1
MCULE-3387172653 0.69 C12OCOC=1C=C(C=CC(=O)OCC=CC1C=CC3OCOC=3C=1)C=C2
MCULE-3175387183 0.69 O=C(C=CC1=CC2=C(OCO2)C=C1)OCC=CC1=CC=CC=C1
MCULE-7083980588 0.69 COC1=C(OC)C(OC)=CC(C=CC(OCCOC(C=CC2=CC(OC)=C(OC)C(OC)=C2)=O)=O)=C1
MCULE-5057063172 0.69 C(C#N)(C(OCC)=O)=CC1C=CC=C(C=1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MolPort-044-227-529 0.69 COc1cc(C=CC(=O)OC(C)C(=O)c2ccccc2)ccc1O
MolPort-044-211-637 0.69 COc1ccc(C=CC(=O)OCC(=O)c2ccccc2)cc1OC
MolPort-044-226-182 0.69 CCc1ccc(cc1)C(=O)COC(=O)C=Cc1ccc(O)c(OC)c1
MolPort-027-722-529 0.69 COc1cccc(C=C(C)C(O)=O)c1
MolPort-046-690-075 0.69 [2H]C([2H])([2H])Oc1ccc(\C=C\C(O)=O)cc1O
MolPort-044-724-678 0.69 O[C@@H]1C[C@@](C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1O)(OC(=O)C=Cc1ccc(O)c(O)c1)C(O)=O
MolPort-035-706-397 0.69 CC1(C)CC[C@@]2(CC[C@]3(COC(=O)\C=C\c4ccc(O)c(O)c4)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)c(O)c6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-039-141-926 0.69 COc1cc(\C=C\C(=O)OC[C@@H](O)c2ccc(O)cc2)ccc1O
MolPort-044-262-318 0.69 CC(=O)CCCCOC(=O)C=Cc1cc(Cl)c2OCCOc2c1
MolPort-035-816-637 0.69 CCCCC1(C)OC(=O)C(=Cc2ccc(OC)c(OCC)c2)C(=O)O1
MolPort-035-394-986 0.69 Oc1ccc(C=CC(=O)OCCc2ccccc2)cc1O
MolPort-044-212-291 0.69 COc1ccc(C=CC(=O)OCc2ccccc2)cc1OC
MolPort-044-227-550 0.69 COc1cc(C=CC(=O)OCCOc2ccccc2)ccc1O
MolPort-046-790-407 0.69 OC1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O
MolPort-044-387-940 0.69 COc1cc(C=CC(=O)OC(C)C#N)ccc1OCC#N
MolPort-044-389-969 0.69 COc1ccc(C=CC(=O)OC(C)c2ccccc2)cc1OC
MolPort-019-936-911 0.69 CC(O)(CC(O)=O)CC(=O)O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-009-242-672 0.69 O=C(OCC=Cc1ccccc1)C=Cc1ccc2OCOc2c1
MolPort-019-904-823 0.69 COc1cc(C=CC(O)=O)cc(OC)c1O
MolPort-003-908-205 0.69 CCOC(=O)C=Cc1ccc(OCc2ccccc2)c(OC)c1
MolPort-002-886-506 0.69 CCOC(=O)C(=Cc1cccc(Oc2ccccc2)c1)C(=O)OCC
MolPort-009-532-430 0.69 COC(=O)C=Cc1ccc(OCCO)c(OC)c1
MolPort-000-492-592 0.69 COC(=O)\C=C\c1ccc2OCOc2c1
MolPort-000-154-620 0.69 COc1cc(\C=C\C(O)=O)cc(OC)c1O
MolPort-000-933-488 0.69 CCOC(=O)C(=C\c1cc(OC)c(OC)c(OC)c1)\C#N
MolPort-003-779-978 0.69 COc1ccc(C=CC(O)=O)cc1O
MolPort-003-909-874 0.69 CCOC(=O)C=Cc1ccc(OC)cc1
MolPort-000-490-526 0.69 COc1ccc(\C=C\C(O)=O)cc1O
MolPort-001-768-521 0.69 CCOC(=O)\C=C\c1ccc(OC)cc1
MolPort-002-810-772 0.69 CCCCCCCCOc1ccc(OC(=O)\C=C\c2ccc(OC)cc2)cc1
MolPort-001-822-508 0.69 CCOC(=O)\C=C\c1ccc(OCc2ccccc2)c(OC)c1
MolPort-000-836-009 0.69 CCOc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)ccc1OC
MolPort-000-886-511 0.69 CCCCOc1ccc(\C=C\C(O)=O)cc1OCC
MolPort-001-740-261 0.69 O[C@@H]1C[C@@](C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-001-741-345 0.69 O[C@@H]1C[C@](C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-000-829-781 0.69 CCCCC1(C)OC(=O)C(=Cc2ccc3OCOc3c2)C(=O)O1
MolPort-002-958-368 0.69 CCCCCCOc1ccc(OCCOc2ccc(\C=C(/C#N)C(=O)OCC)cc2OC)cc1
MolPort-005-945-816 0.69 CC(O)(C(O)COC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
MolPort-001-742-205 0.69 COc1ccc(\C=C\COC(=O)C(\COC(=O)C(\C)=C\C)=C/C)cc1OC
MolPort-001-017-636 0.69 COC(=O)C(=C\c1ccc(OC)c(OC)c1)\C#N
MolPort-003-665-504 0.69 Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O
MolPort-002-329-115 0.69 O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc2OCOc2c1
MolPort-046-509-643 0.69 CCOc1cc(C=CC(O)=O)ccc1O
MolPort-035-706-396 0.69 CC1(C)CC[C@@]2(CC[C@]3(COC(=O)\C=C\c4ccc(O)c(O)c4)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-044-227-533 0.69 COc1ccc(cc1)C(=O)COC(=O)C=Cc1ccc(O)c(OC)c1
MolPort-044-227-570 0.69 COc1cc(C=CC(=O)OCCOc2ccc(C)cc2)ccc1O
MolPort-044-414-611 0.69 COc1cc(C=CC(=O)OCCOC(=O)C=Cc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
MolPort-044-389-985 0.69 COc1ccc(C=CC(=O)OCc2ccc(COC(=O)C=Cc3ccc(OC)c(OC)c3)cc2)cc1OC
MolPort-018-572-665 0.68 COCCOC(=O)C(=Cc1ccc(O)c(OC)c1)C#N
MolPort-002-833-238 0.68 COc1cc(C=C2C(=O)OC3(CCCC3)OC2=O)cc(OC)c1OC
MolPort-002-329-142 0.68 CCOc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1OC
MolPort-021-804-792 0.68 COc1cc(\C=C\C(=O)OC(C(OC(=O)\C=C\c2ccc(O)c(O)c2)C(O)=O)C(O)=O)ccc1O
MolPort-005-220-398 0.68 COc1cc(C=CC(O)=O)ccc1OC(C)C
MolPort-044-212-277 0.68 COc1ccc(C=CC(=O)OC(C)C(=O)c2ccccc2)cc1OC
MolPort-029-943-012 0.68 OC1C(CC(O)(CC1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)CC(O)=O
MolPort-044-387-451 0.68 COC(=O)C=Cc1ccc(OC(F)F)c(OC)c1
MolPort-044-392-759 0.68 COC(=O)C=Cc1ccc(OC(=O)CCCOc2cccc(C)c2)c(OC)c1
MolPort-046-684-176 0.68 CCOC(=O)\C=C\c1ccc(OC)c2ccccc12
MolPort-039-141-824 0.68 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)\C=C\c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-028-599-896 0.68 COc1cc(\C=C\C(=O)OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O
MolPort-019-936-956 0.68 COc1cc(\C=C\C(=O)OCC2OC(OC3(CO)OC(CO)C(O)C3O)C(O)C(O)C2O)ccc1O
MolPort-021-804-508 0.68 COc1cc(\C=C\C(=O)OCC2OC(CO)(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)ccc1O
MolPort-044-637-514 0.68 COc1cc(\C=C\C(=O)OC[C@H]2O[C@@](CO)(O[C@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)ccc1O
MolPort-042-675-435 0.68 COc1cc(\C=C/C(=O)OC[C@H]2O[C@@](CO)(O[C@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)ccc1O
MolPort-046-793-401 0.68 [Na+].O[C@@H]1C[C@](C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C([O-])=O
MolPort-000-492-413 0.68 COc1cc(\C=C\C(O)=O)ccc1OC(C)C
MolPort-046-158-517 0.68 Oc1ccc(\C=C\C(=O)OC\C=C\c2ccccc2)cc1O
MolPort-044-383-232 0.68 COc1cc(C=CC(=O)OCCCOc2ccccc2)ccc1OCC#N
MolPort-044-243-196 0.68 CC(=CC(=O)OCC1CCCCO1)c1ccccc1
MolPort-044-222-694 0.68 COC(=O)C=Cc1ccc(OCC2(CO)COC2)c(OC)c1
MolPort-028-917-319 0.68 CCOC(=O)C(\Cl)=C\c1ccc(OC)c(OC)c1
MolPort-044-227-571 0.68 COc1ccc(OCCOC(=O)C=Cc2ccc(O)c(OC)c2)cc1
MolPort-044-226-093 0.68 CCOc1cc(C=C(C#N)C(=O)OC)ccc1O
MolPort-044-213-966 0.68 CC(OC(=O)C=Cc1ccc2OCOc2c1)C#N
MCULE-2395651852 0.68 CC12CCC3([H])C4(CCC(O)CC4([H])CC(O)C3([H])C1([H])CCC2([H])C(C)CCC(=O)OC1C=CC(C=CC(=O)OCCCCON(=O)=O)=CC=1OC)C
MCULE-7483218833 0.68 C1=CC=CC(C=CC(=O)OCCCC)=C1
MCULE-2851885500 0.68 CCOC(C(C#N)=C(C1=CC(OC)=C(OC)C=C1)C)=O
MCULE-5269580490 0.68 C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)O
MCULE-4825386658 0.68 C(=CC1=CC=C(C(O)=C1)O)C(OC)=O
MCULE-1597785199 0.68 O(C(/C=C/C1=CC=CC=C1)=O)CCCC
MCULE-6626423425 0.68 C(C#N)(=C(C)C1=CC=C(C(OC)=C1)OC)C(=O)OC(C)C
MCULE-9303169142 0.68 COC1=C(OCC#N)C=CC(C=CC(OCCCOC2=CC=CC=C2)=O)=C1
MCULE-8439563922 0.68 C1C=C(C=CC(=O)OCCC(C)C)C=CC=1
MCULE-4915693180 0.68 C(OC(C)C)(=O)C=CC1=CC=C(C=C1)OCC
MCULE-5506234860 0.68 O1COC2C=CC(C=C(CC(O)=O)C(OCC)=O)=CC1=2
MCULE-6548623647 0.68 C(=CC1C=CC(=CC=1)OCCCC)C(OC)=O
MCULE-7447390962 0.68 C(O)(=O)C=CC1C=CC=C(OCCCC)C=1
MCULE-2542199611 0.68 C1(C=CC(=CC=1OC)C=CC(O)=O)OC(C)C
MCULE-9484760084 0.68 C1(=C/C2=CC=C(C(OC)=C2)OCC)/C(=O)OC2(OC/1=O)CCCC2
MCULE-7826412349 0.68 O1C(CCCC1)OC1C(OC)=CC(C=CC(OC2CCCCO2)=O)=CC=1
MCULE-8934045937 0.68 C(=CC(OC(C)C)=O)C1=CC(OC)=CC=C1OC
MCULE-7560822669 0.68 C1(=C/C2=CC(OC)=C(C(OC)=C2)OC)\C(=O)OC2(OC\1=O)CCCC2
MCULE-6520581309 0.68 C1=C(O)C(=CC(/C=C/C(=O)OCC2OC(OC3(OC(C(C3O)O)CO)CO)C(O)C(O)C2O)=C1)OC
MCULE-1277285732 0.68 O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2C=C(OC)C(O)=CC=2)O[C@@]1(CO)O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O1
MCULE-4982409104 0.68 O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C\C2C=CC(O)=C(OC)C=2)O[C@@]1(CO)O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O1
MCULE-9358082696 0.68 [C@H]1(COC(=O)/C=C/C2C=CC(O)=C(OC)C=2)O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-8520107045 0.68 C1(CO)OC(OC2(CO)OC(COC(=O)/C=C/C3C=C(OC)C(O)=CC=3)C(O)C2O)C(O)C(O)C1O
MCULE-2849828641 0.68 C(=CC1C=CC(=C(OCC)C=1)OCC1C=CC=CC=1)C(OCC)=O
MCULE-5264574155 0.68 C(=CC1=CC=C(C(OC)=C1)OCC1=CC=C(C=C1)C)C(OCC)=O
MCULE-9467687349 0.68 C1(OCC)=C(OCC)C=CC(C=C(C#N)C(OCC)=O)=C1
MCULE-5465372429 0.68 COCCOC(C(C#N)=CC1=CC(OC)=C(O)C=C1)=O
MCULE-8853378868 0.68 C(C)(C(=CC1C=CC2OCOC=2C=1)C(OC)=O)=O
MCULE-6835484451 0.68 C(=C(CC(O)=O)C(OC(C)(C)C)=O)(C1C=CC(OC)=C(OC)C=1)C1C=CC(OC)=C(OC)C=1
MCULE-5421286651 0.68 C(/C(/CC(O)=O)=C(/C1C=CC(OC)=C(OC)C=1)\C1=CC=C(OC)C(OC)=C1)(OCC)=O
MCULE-6613332253 0.68 CCOC(C=CC1=CC=C(OC)C2=C1C=CC=C2)=O
MCULE-2004373121 0.68 CCCOC1=CC=C(C=CC(OCC)=O)C=C1
MCULE-2744888729 0.68 C(OC(C)C)(=O)C=CC1C=CC(=CC=1)OCCC
MCULE-8465188057 0.68 C1C=CC(C=C(CC)C(=O)O)=CC=1OC
MCULE-5153601925 0.68 COC(C=CC1=CC(OC)=C(OC(F)F)C=C1)=O
MCULE-1279561091 0.68 CC(C1=CC=CC=C1)=CC(OCC1OCCCC1)=O
MCULE-6793033862 0.68 COC(C=CC1=CC(OC)=C(OCC2(COC2)CO)C=C1)=O
MCULE-3467193602 0.68 COC1=CC=C(OCCOC(C=CC2=CC(OC)=C(O)C=C2)=O)C=C1
MCULE-8104250483 0.68 CCOC1=C(O)C=CC(C=C(C(OC)=O)C#N)=C1
MCULE-6432740541 0.68 C(=O)(OC1=CC=C(C=C1)C(C)(C)C)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3726479113 0.68 C(Cl)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)OC
MCULE-4322357601 0.68 C(=O)(OC1C=CC(=CC=1)C(C)C)C=CC1=CC=C(C(OC)=C1)OC
MCULE-9475108087 0.68 C(OCC(OC)=O)(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-7257224552 0.68 C(C#N)(C(OC)=O)=CC1=CC(=C(O)C(OC)=C1)OC
MCULE-4439455338 0.68 COC1=C(O)C=C(C=CC(OC2C(=O)OCC2)=O)C=C1
MCULE-6890437025 0.68 C(C#N)(C(OCC)=O)=CC1C=CC=C(OCCCC)C=1
MCULE-7802046976 0.68 COC(C=CC1=CC(OC)=C(OC(CCCOC2=CC(C)=CC=C2)=O)C=C1)=O
MCULE-1215196519 0.68 CC(C#N)OC(C=CC1=CC2=C(OCO2)C=C1)=O
MCULE-5873495656 0.68 COC1=C(OC)C=C(C=CC(OC(C(C2=CC=CC=C2)=O)C)=O)C=C1
MCULE-1381143762 0.68 C(=O)(OC1=CC=C(C=C1)C1C=CC(=CC=1)C)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-5022540916 0.68 O=C(C=CC1=CC2=C(OCO2)C=C1)OC1COCC1
MCULE-8724827201 0.68 CC(C1C(OC(COC(C(C#N)=CC2=CC3=C(OCO3)C=C2)=O)=O)CC(C)CC1)C
MCULE-2378288733 0.68 O(C(=O)/C=C/C1C=CC(O)=C(OC)C=1)[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2C=C(OC)C(O)=CC=2)O[C@@]1(CO)O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O1
MCULE-1037663670 0.68 [C@@H]1(O)[C@@H](CO)O[C@@](CO)(O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-5716265674 0.68 [C@@H]1(CO)[C@@H](O)[C@H](OC(=O)/C=C/C2C=C(OC)C(O)=CC=2)[C@](CO)(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O1
MolPort-002-747-457 0.68 COC(=O)\C=C\c1ccc(O)c(O)c1
MolPort-039-339-137 0.68 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
MolPort-044-414-945 0.68 CC(C)C1CCC(C)CC1OC(=O)COC(=O)C(=Cc1ccc2OCOc2c1)C#N
MolPort-019-937-347 0.68 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
MolPort-042-675-437 0.68 COc1cc(\C=C\C(=O)OC[C@H]2O[C@@](CO)(O[C@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)\C=C\c3ccc(O)c(OC)c3)[C@@H]2O)ccc1O
MolPort-039-338-760 0.68 Oc1ccc(\C=C\C(=O)OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
MolPort-009-660-403 0.68 CCOC(=O)C(C#N)=C(C)c1ccc(OC)c(OC)c1
MolPort-000-225-793 0.68 CCOC(=O)C(\C#N)=C(/C)c1ccc(OC)c(OC)c1
MolPort-003-913-152 0.68 CC(C)CCOC(=O)\C=C\c1ccccc1
MolPort-001-673-019 0.68 COc1ccc(cc1OC)C(\C)=C(/C#N)C(=O)OC(C)C
MolPort-028-264-970 0.68 O=C(OC1CCOC1)C=Cc1ccc2OCOc2c1
MolPort-001-534-414 0.68 CCCCOc1cccc(\C=C(/C#N)C(=O)OCC)c1
MolPort-001-645-477 0.68 COC(=O)COC(=O)\C=C\c1ccc(OC)c(OC)c1
MolPort-002-046-413 0.68 COc1ccc(\C=C\C(=O)Oc2ccc(cc2)C(C)C)cc1OC
MolPort-001-485-413 0.68 COC(=O)C(=C\c1cc(OC)c(O)c(OC)c1)\C#N
MolPort-003-741-940 0.68 CC\C(=C/c1cccc(OC)c1)C(O)=O
MolPort-044-389-982 0.67 COc1ccc(C=CC(=O)OCC(=O)c2ccc(cc2)C2CCCCC2)cc1OC
MolPort-044-408-656 0.67 COc1ccc(C=C(C#N)C(=O)OCC(=O)OC2CC(C)CCC2C(C)C)cc1
MolPort-044-258-721 0.67 COCCOc1ccc(C=CC(=O)OC)cc1OC
MolPort-044-213-332 0.67 COc1cc(C=CC(=O)OCC(=O)c2ccccc2)cc(OC)c1OC
MolPort-028-934-122 0.67 CCOC(=O)C(=C\c1cccc(Oc2ccccc2)c1)\C#N
MolPort-044-212-292 0.67 COc1ccc(C=CC(=O)OCC(N)=O)cc1OC
MolPort-044-390-786 0.67 COc1ccc(OC(=O)C=Cc2ccc(OC)c(OC)c2)cc1
MolPort-044-226-097 0.67 COc1cc(C=C(C#N)C(O)=O)ccc1O
MolPort-022-378-549 0.67 COC\C=C\c1ccc(O)c(OC)c1
MolPort-022-377-738 0.67 CCOC(=O)\C=C\c1cccc(O)c1
MolPort-028-616-570 0.67 COc1cccc(\C=C/C(O)=O)c1
MolPort-044-393-289 0.67 CCOc1cc(C=CC(=O)OCC(=O)C(C)(C)C)ccc1OCCOc1ccc(F)cc1
MolPort-044-215-244 0.67 COc1cccc(C=C(C(=O)OCC(=O)C(C)(C)C)c2ccccc2)c1
MolPort-035-706-449 0.67 C[C@H]1[C@H](COC(=O)\C=C\c2ccc(O)cc2)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12)C(O)=O
MolPort-019-936-813 0.67 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)cc2)[C@H]1O)C(O)=O
MolPort-044-214-112 0.67 O=C(OCC#N)C=Cc1ccc2OCOc2c1
MolPort-028-934-123 0.67 CC(C)COC(=O)C(=C/c1cccc(Oc2ccccc2)c1)\C#N
MolPort-044-213-384 0.67 COc1ccccc1C=CC(=O)OCC(=O)C(C)(C)C
MolPort-044-414-425 0.67 CCOC(=O)C=Cc1ccc(OCCCC=C)cc1
MolPort-000-886-557 0.67 CCOc1cc(\C=C\C(O)=O)ccc1OC(C)C
MolPort-016-540-708 0.67 COc1ccc(\C=C\C(O)=O)cc1OC(C)C
MolPort-000-183-089 0.67 CCOc1ccc(\C=C\C(O)=O)cc1OC
MolPort-003-741-925 0.67 C\C(=C/c1ccc2OCOc2c1)C(O)=O
MolPort-002-725-553 0.67 COc1ccc(\C=C2\C(=O)C(C)(C)OC2(C)C)cc1OC
MolPort-002-886-739 0.67 CCOC(=O)C(=Cc1cccc(Oc2ccc(CC)cc2)c1)C(=O)OCC
MolPort-006-827-435 0.67 COC(=O)C(\CC(O)=O)=C\c1cccc(OC)c1
MolPort-001-785-893 0.67 COc1cc(\C=C(/C#N)C(O)=O)ccc1O
MolPort-000-652-914 0.67 COc1cc(\C=C(\C#N)C(O)=O)ccc1O
MolPort-000-490-788 0.67 COc1cc(\C=C\C(O)=O)ccc1OCC(C)C
MolPort-019-707-114 0.67 CCCCCOc1ccc(\C=C\C([O-])=O)cc1
MolPort-003-726-796 0.67 CCOc1ccc(C=CC(O)=O)cc1OC
MolPort-000-886-426 0.67 CCCOc1ccc(\C=C\C(O)=O)cc1OC
MolPort-000-685-197 0.67 COc1cc(\C=C\C(O)=O)cc(OC)c1OC
MolPort-004-288-326 0.67 COc1cc(C=CC(O)=O)cc(OC)c1OC
MolPort-004-288-324 0.67 COc1cccc(C=CC(O)=O)c1
MolPort-000-886-278 0.67 COc1cccc(\C=C\C(O)=O)c1
MolPort-001-840-877 0.67 COc1cc(\C=C2/COC\C(=C/c3cc(OC)c(OC)c(OC)c3)C2=O)cc(OC)c1OC
MolPort-001-740-213 0.67 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)cc2)[C@@H]1O)C(O)=O
MolPort-000-753-631 0.67 CCOC(=O)C(=Cc1ccc(OCCCCCOc2ccc(C=C(C(=O)OCC)C(=O)OCC)cc2)cc1)C(=O)OCC
MolPort-000-653-701 0.67 CC12CC3CC(COC(=O)\C=C\c4ccccc4)(C1)CC(C3)(C2)c1ccccc1
MolPort-000-148-250 0.67 CCCCCOc1ccc(\C=C\C(O)=O)cc1
MCULE-4524676206 0.67 C1(C=CC(=CC=1OCC)C=CC(O)=O)OC(C)C
MCULE-9406290643 0.67 C1C=C(/C=C/C(=O)OC(/C=C/C2C=C(O)C(O)=CC=2)=O)C=C(O)C=1O
MCULE-6911603172 0.67 C1=C(OC)C(=CC(C=CC(=O)O)=C1)OC(C)C
MCULE-2279884661 0.67 C1(O)=C(C=C(C=C1C(C)(C)C)CCCCOC(=O)C=CC1C=CC=CC=1)C(C)(C)C
MCULE-7537247144 0.67 COC1=C(C=CC(OCC(C(C)(C)C)=O)=O)C=CC=C1
MCULE-1992598221 0.67 CCOC(C=CC1=CC=C(OCCCC=C)C=C1)=O
MCULE-2742613943 0.67 C12(C3C=CC=CC=3)CC3CC(C)(CC(C3)(COC(=O)C=CC3C=CC=CC=3)C1)C2
MCULE-3772742110 0.67 C1[C@@](O)(C(O)=O)C[C@H]([C@@H]([C@@H]1O)O)OC(/C=C/C1C=CC(O)=CC=1)=O
MCULE-3570797550 0.67 C1(C=C(C=CC=1OC)C=CC(OCC)=O)OCC1=CC=CC2=CC=CC=C12
MCULE-3070323660 0.67 O1C2C=C(/C=C(\C(=O)OCC)/C(=O)OCC)C=CC=2OC1
MCULE-1018357469 0.67 C1[C@@H](OC(=O)/C=C/C2C=CC(O)=CC=2)[C@@H](O)[C@@H](C[C@@]1(C(=O)O)O)O
MCULE-7425035348 0.67 C(=C/C1C=CC(=CC=1)OCCCCCOC1=CC=C(C=C1)/C=C(/C(OCC)=O)\C(OCC)=O)(/C(OCC)=O)\C(OCC)=O
MCULE-4544844900 0.67 C(C#N)(=CC1C=CC=C(C=1)OC1C=CC=CC=1)C(=O)OCC(C)C
MCULE-6458252315 0.67 C(=CC1=CC=C(C(OC)=C1)OCC1=CC=C(C=C1)C(C)(C)C)C(OCC)=O
MCULE-1363154911 0.67 C(=CC1=CC=C(C(OC)=C1)OCC1C=CC=CC=1)C(OCC=C)=O
MCULE-8607422384 0.67 O=C(C=CC1=CC2=C(OCO2)C=C1)OCC#N
MCULE-7018990527 0.67 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCC1C=CC(=CC=1)C(C)(C)C
MCULE-6645479881 0.67 C1(OC)C(OC)=CC(C=C2COCC(=CC3=CC(=C(OC)C(OC)=C3)OC)C2=O)=CC=1OC
MCULE-6177972597 0.67 C(C#N)(C(OCC)=O)=CC1C=CC=C(C=1)OC(CCCC)=O
MCULE-6336757858 0.67 COC1=CC(C=C(C2=CC=CC=C2)C(OCC(C(C)(C)C)=O)=O)=CC=C1
MCULE-8338592995 0.67 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OC(C1CCCCC1)=O
MCULE-5225693007 0.67 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OC(CCCC)=O
MCULE-1066432208 0.67 CCOC1=C(OCCOC2=CC=C(F)C=C2)C=CC(C=CC(OCC(C(C)(C)C)=O)=O)=C1
MCULE-6022384798 0.67 C1(OC)C=C(/C=C/COC)C=CC=1O
MCULE-5752702758 0.67 C(O)(=O)C=CC1=CC=CC(OC)=C1
MCULE-6011496910 0.67 C(O)(=O)C=CC1C=CC(=CC=1)OCCCCC
MCULE-8351376607 0.67 C1(OC)C(OC)=CC(=CC=1OC)/C=C/C(O)=O
MCULE-9707776041 0.67 CCOC(C=CC1=CC=C(OCC)C=C1)=O
MCULE-1633691755 0.67 C(OCC)(C=CC1C=CC=C(O)C=1)=O
MCULE-9669475860 0.67 C1(OC)C(OC)=CC(=CC=1OC)C=CC(O)=O
MCULE-6800666719 0.67 C(O)(=O)C=CC1C=CC(=C(OC)C=1)OCC
MCULE-5916017124 0.67 O=C(OCC)/C=C/C1C=CC=C(O)C=1
MCULE-7759406514 0.67 C(C#N)(C(OCC)=O)=CC1C=CC=C(C=1)OC1=CC=CC=C1
MCULE-4173386108 0.67 COC1=C(OCC(C)C)C=CC(C=CC(O)=O)=C1
MCULE-9018774008 0.67 COC1=C(O)C=CC(C=C(C(O)=O)C#N)=C1
MCULE-1328002327 0.67 COC1=C(OC)C=C(C=CC(OCC(N)=O)=O)C=C1
MCULE-7163853237 0.67 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCC1C=CC=CC=1C
MCULE-4293441798 0.67 C(/C(OCC)=O)(\C(OCC)=O)=C\C1=CC=CC(=C1)OC1C=CC(=CC=1)CC
MCULE-2857557653 0.67 C(=CC(OCC)=O)C1=CC(OC)=CC=C1OC
MCULE-7736927884 0.67 C(CC(O)=O)(C(OC)=O)=CC1C=CC=C(OC)C=1
MCULE-9512039229 0.67 CCCOC1=C(OC)C=C(C=CC(O)=O)C=C1
MCULE-3428455608 0.67 C1=C(/C=C(\CC(O)=O)/C(=O)OC)C=CC=C1OC
MCULE-7281458869 0.67 COC1C=C(/C=C(\C(=O)O)/C#N)C=CC=1O
MCULE-6355537535 0.67 COCCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-5657158883 0.67 COC1=CC=C(OC(C=CC2=CC(OC)=C(OC)C=C2)=O)C=C1
MCULE-7592653848 0.67 C(OC)(=O)C1=CC=C(C=C1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-6038728729 0.67 C1(=CC2=CC=C(C(OC)=C2)OC)C(C)(C)OC(C)(C)C1=O
MCULE-6042883320 0.67 C1(=C/C2=CC=C(C(OC)=C2)OC)/C(C)(C)OC(C)(C)C/1=O
MCULE-2882192050 0.67 C(C(C)=O)(=CC1C=CC=CC=1)C(=O)OC1CC(C)CCC1C(C)C
MCULE-7444824438 0.67 C(C)(C(O)=O)=CC1C=CC2=C(OCO2)C=1
MCULE-7986336039 0.67 C1(OC)=C(OC)C=C(C=C1Br)C=CC(OC(C)C)=O
MCULE-8643427322 0.67 COC1=CC=C(C=C(C(OCC(OC2C(C(C)C)CCC(C)C2)=O)=O)C#N)C=C1
MCULE-5634347799 0.67 C(=O)(OC1C=CC(=CC=1)C=O)C=CC1C=CC(OCCCCCCCCCC)=CC=1
MCULE-1231040107 0.67 COC1=C(OC)C(OC)=CC(C=CC(OCC(C2=CC=CC=C2)=O)=O)=C1
MCULE-1343944249 0.67 C(=CC1=CC=C(C(OC)=C1)OCC1C=CC=CC=1)C(OC)=O
MCULE-1714306739 0.67 C(=O)(OC1C=CC(=CC=1)C=O)C=CC1C=CC(OCCCCCCCCCCCC)=CC=1
MCULE-4867987928 0.67 C(=O)(OC1C=CC(=CC=1)C=O)C=CC1C=CC(OCCCCCCCCC)=CC=1
MCULE-8382785411 0.67 C(=CC1=CC=C(C(OC)=C1)OCC1=CC=C(C=C1)C)C(OCC=C)=O
MCULE-4026541410 0.67 C(=O)(OC1C=CC(=CC=1)C=O)C=CC1C=CC(OCCCCCCCC)=CC=1
MCULE-4377928130 0.67 C(=O)(OC1C=CC(=CC=1)C=O)C=CC1C=CC(OCCCCCCC)=CC=1
MCULE-5269287179 0.67 COC1=C(OC)C=C(C=CC(OCC(C2=CC=C(C3CCCCC3)C=C2)=O)=O)C=C1
MCULE-4346874840 0.67 C1(CC(OC1=O)CCCCC)=CC1=CC=C(C=C1)OCCCCCCCCC
MCULE-5422267757 0.66 CCOC(C(C#N)=CC1=CC(OCC)=C(OCC(C)C)C=C1)=O
MCULE-6116840376 0.66 C1(C=C(C=CC=1OC)C=CC(OCC=C)=O)OCC1=CC=CC2=CC=CC=C12
MCULE-2190263203 0.66 COC1=CC(OC)=C(C=CC(OCC(C(C)(C)C)=O)=O)C=C1
MCULE-7772355214 0.66 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OCC)C=1)OCCC
MCULE-1707365370 0.66 C(=CC1=CC=C(C(OC)=C1)OCC1C=CC=CC=1C)C(OCC)=O
MCULE-1793463224 0.66 C1(=CC(=CC=C1OC(OC)=O)C=CC(OC(C)C)=O)OC(OC)=O
MCULE-8311000791 0.66 C(C#N)(C(OCC)=O)=CC1=CC=C2C(OCO2)=C1
MCULE-2505913195 0.66 C(/C#N)(\C(OCC)=O)=C/C1=CC=C2C(OCO2)=C1
MCULE-2562746068 0.66 C1(=CC(=CC(OC)=C1)OC)C=C(C#N)C(=O)OC(C)(C)C
MCULE-1060066648 0.66 C1(C=C(C=CC=1OC)C=CC(OC)=O)OCC1C=CC=CC=1
MCULE-1709096609 0.66 COC(C=CC1=CC(OC)=C(OC(/C=C(/C)\C)=O)C=C1)=O
MCULE-7295989322 0.66 CCCCOC(C(C#N)=CC1=CC=C(O)C=C1)=O
MCULE-7453909302 0.66 COC1=C(O)C=CC(C=C(C2=CC=CC=C2)C(O)=O)=C1
MCULE-8553548590 0.66 CCOC(C(C#N)=CC1=CC(OC)=CC(OC)=C1)=O
MCULE-8775569558 0.66 C(=CC1=CC=C(C(OC)=C1)OCC1=CC=CC2=CC=CC=C12)C(OC)=O
MCULE-4053972337 0.66 C(=CC1C=CC(=C(OCC)C=1)OCC1C=CC=CC=1)C(OC)=O
MCULE-6883573701 0.66 C(OC(C)C)(=O)C=CC1=CC=CC(=C1)OCC1=CC=CC=C1
MCULE-5852044096 0.66 COC1=CC(C=C(C(OC(C)C)=O)C#N)=CC(OC)=C1
MCULE-3996502655 0.66 C1(CCOC1=O)=CC1C=CC(=CC=1)OC
MCULE-5020420805 0.66 C(C(C)=O)(=CC1=CC=C(C=C1)O)C(OCC)=O
MCULE-6222964274 0.66 C(=CC1C=CC2=C(C=CC(OCCCC)=C2)C=1)C(OC)=O
MCULE-2705718395 0.66 COC1=C(OCC=C)C=CC(C=CC(O)=O)=C1
MCULE-2800917117 0.66 C(O)(=O)C=CC1=CC=CC(OC(C)C)=C1
MCULE-9216241643 0.66 C1(=C/C2=CC=C(C(OC)=C2OC)OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-9085672619 0.66 [C@H]1(O)[C@@H]([C@](O[C@@H]1CO)(CO)O[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(=O)/C=C/C1=CC(OC)=C(O)C(OC)=C1)O
MCULE-5566770996 0.66 C1(=C/C2C=CC(=C(OC)C=2)OCC2C=CC=CC=2)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-9987459279 0.66 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-1689485269 0.66 C1(OC)=C(C=CC(=C1)/C=C/CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)O
MCULE-3904192426 0.66 CCOC1=CC=C(C(C(OC(C=CC2=CC(OC)=C(O)C=C2)=O)C)=O)C=C1
MCULE-6754508237 0.66 COC1=CC(C=CC(O[C@@H]2C(C)(C)COC2=O)=O)=CC(OC)=C1
MCULE-1261781514 0.66 C(C#N)(C(OCC)=O)=C(C)C1=CC(OC)=C(C(OC)=C1)OC
MCULE-3719095177 0.66 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OC(CCCC)=O
MCULE-9130055726 0.66 CCOC1=C(OC2CCCCC2)C(C=CC(O)=O)=CC=C1
MCULE-3283120914 0.66 CC(C#N)OC(C=CC1=CC2=C(OCCO2)C=C1)=O
MCULE-7945219032 0.66 COC(=O)COC1C=CC(C=CC(=O)OCC)=CC=1OC
MCULE-1070002455 0.66 C1(OCCCl)C=CC(C=CC(=O)OC)=CC=1OC
MCULE-3703167944 0.66 C(=O)(OC1=CC=C(C=C1)CC)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-4968878198 0.66 C(=O)(OC1C=CC=C(C)C=1)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-7856049791 0.66 C1C(C=C(C(=O)OC)OC)=CC(OC)=C(O)C=1
MCULE-6122743920 0.66 C1(OC)=C(OC)C=C(C=C1Br)C=CC(OCC)=O
MCULE-2468175287 0.66 C1(C(OC)=CC(/C=C/C(OCC[N+](C)(C)C)=O)=CC=1OC)O
MCULE-1110038171 0.66 C1(OC)=C(OC)C=CC(=C1Cl)C=CC(OCC)=O
MCULE-2333950885 0.66 C(OC)(=O)C(=CC1C=C(OC)C=C(OC)C=1)C(OC)=O
MCULE-2331942805 0.66 C(C(O)=O)(=CC1C=CC(OC)=C(OC)C=1)C#N
MCULE-7744159997 0.66 COC1=CC=C(C=CC(OCC(COC(C=CC2=CC=C(OC)C=C2)=O)=O)=O)C=C1
MolPort-001-761-889 0.66 CCOC(=O)\C=C\c1ccc(OC)c(OC)c1Cl
MolPort-035-785-071 0.66 [Na+].COc1cc(\C=C\C([O-])=O)cc(OC)c1OC
MolPort-044-207-354 0.66 COC(=O)C(=Cc1cc(OC)c(OC)c(OC)c1)C#N
MolPort-044-213-162 0.66 COc1cc(C=CC(=O)OCc2ccccc2)cc(OC)c1OC
MolPort-044-221-182 0.66 CCCOc1ccc(C=CC(=O)OCCCNC(C)(C)C)cc1OCC
MolPort-001-023-006 0.66 COc1ccc(\C=C(/C#N)C(O)=O)cc1OC
MolPort-000-669-523 0.66 CCOc1ccc(\C=C\C(=O)Oc2cccc(C)c2)cc1OCC
MolPort-000-672-258 0.66 CCCCCCOc1ccc(\C=C\C(=O)Oc2ccc(\C=C(/C#N)C(=O)OC)cc2OC)cc1OC
MolPort-013-327-657 0.66 CCOc1cccc(\C=C\C(O)=O)c1OC1CCCCC1
MolPort-000-225-795 0.66 CCOC(=O)C(\C#N)=C(/C)c1cc(OC)c(OC)c(OC)c1
MolPort-000-664-864 0.66 CCCCC(=O)Oc1ccc(\C=C(/C#N)C(=O)OC)cc1OC
MolPort-001-740-471 0.66 COc1cc(\C=C\CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
MolPort-001-962-116 0.66 COc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)ccc1OCc1ccccc1
MolPort-046-418-778 0.66 COc1cc(C=CC(=O)OCCCCO[N+]([O-])=O)ccc1OC(=O)CCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
MolPort-007-567-545 0.66 COc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)c(OC)c1OC
MolPort-046-773-929 0.66 [K+].COc1cccc(\C=C\C([O-])=O)c1
MolPort-019-937-020 0.66 COc1cc(\C=C\C(=O)OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O
MolPort-046-702-250 0.66 COc1cc(\C=C\C(=O)OCCCCO[N+]([O-])=O)ccc1OC(=O)CCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
MolPort-044-377-462 0.66 CCOC(=O)C(=Cc1ccc(O)cc1)C(C)=O
MolPort-046-418-689 0.66 COc1cc(\C=C\C(=O)OCC[N](C)(C)C)cc(OC)c1O
MolPort-044-209-927 0.66 CC(OC(=O)C=Cc1ccc2OCCOc2c1)C#N
MolPort-028-266-014 0.66 COc1cc(OC)cc(C=CC(=O)O[C@H]2C(=O)OCC2(C)C)c1
MolPort-044-227-606 0.66 CCOc1ccc(cc1)C(=O)C(C)OC(=O)C=Cc1ccc(O)c(OC)c1
MolPort-019-937-502 0.66 OC[C@H]1O[C@@H](OC2CCCCC2O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@@H]1O
MolPort-002-872-742 0.66 CCCCOc1ccc2cc(\C=C\C(=O)OC)ccc2c1
MolPort-044-377-903 0.66 CCCCOC(=O)C(=Cc1ccc(O)cc1)C#N
MolPort-035-706-082 0.66 COc1cc(C[C@H]2CO[C@@H]([C@H]2COC(=O)\C=C\c2ccc(O)c(OC)c2)c2ccc(O)c(OC)c2)ccc1O
MolPort-020-108-592 0.66 COc1cc(C=C(C(O)=O)c2ccccc2)ccc1O
MolPort-044-216-892 0.66 COC(=O)C=Cc1ccc(OC(=O)C=C(C)C)c(OC)c1
MolPort-044-387-485 0.66 CCOC(=O)C(=Cc1cc(OC)cc(OC)c1)C#N
MolPort-044-245-368 0.66 COc1cc(OC)cc(C=C(C#N)C(=O)OC(C)C)c1
MolPort-044-213-038 0.66 COc1ccc(C=CC(=O)OCC(=O)C(C)(C)C)c(OC)c1
MolPort-044-244-062 0.66 CCOC(=O)C(=Cc1ccc(OCC(C)C)c(OCC)c1)C#N
MolPort-009-649-138 0.66 CC(C)Oc1cccc(\C=C\C(O)=O)c1
MolPort-009-309-157 0.66 CCOc1cccc(C=CC(O)=O)c1OC1CCCCC1
MolPort-002-181-484 0.66 CCOC(=O)C(=C\c1ccc(O)cc1)\C(C)=O
MolPort-000-490-741 0.66 COc1cc(\C=C\C(O)=O)ccc1OCC=C
MolPort-001-832-953 0.66 COC(=O)\C=C\c1ccc(OC)cc1
MolPort-003-760-254 0.66 COc1cccc(\C=C\C(O)=O)c1O
MolPort-000-490-638 0.66 CCOc1cc(\C=C\C(O)=O)ccc1OC
MolPort-002-559-049 0.66 [Li+].CCCCCOc1ccc(\C=C\C([O-])=O)cc1
MolPort-005-220-311 0.66 CCOc1ccc(C=CC(O)=O)cc1OCC
MolPort-000-490-608 0.66 CCOc1ccc(\C=C\C(O)=O)cc1OCC
MolPort-000-933-459 0.66 COC(=O)C(=C\c1cccc(OC)c1)\C#N
MolPort-000-492-034 0.66 CCCOc1ccc(\C=C\C(O)=O)cc1OCC
MolPort-002-916-132 0.66 COc1cc(C=C(C(O)=O)C(O)=O)cc(OC)c1OC
MolPort-002-464-692 0.66 CCOc1cc(\C=C\C(O)=O)ccc1OCC(C)C
MolPort-001-740-373 0.66 CC(C)C1C(CC2(C)OC2CCC2(C)OC2C1O)OC(=O)\C=C\c1ccccc1
MolPort-009-674-579 0.66 COC(=O)C=Cc1ccc2OCCOc2c1
MolPort-002-046-409 0.66 COc1ccc(\C=C\C(=O)Oc2cc(C)cc(C)c2)cc1OC
MolPort-002-046-432 0.66 COc1ccc(\C=C\C(=O)Oc2ccc(C)c(C)c2)cc1OC
MolPort-005-310-347 0.66 COC(=O)\C=C\c1ccc(OC)c(OC)c1OC
MolPort-002-749-744 0.66 COC(=O)\C=C\c1ccc2OCCOc2c1
MolPort-000-669-524 0.66 CCOc1ccc(\C=C\C(=O)Oc2ccccc2)cc1OCC
MolPort-009-237-931 0.66 O=C(OCC=Cc1ccccc1)C=Cc1ccc2OCCOc2c1
MolPort-000-933-462 0.66 COC(=O)C(=C\c1cc(OC)c(OC)c(OC)c1)\C#N
MolPort-001-023-779 0.66 COC(=O)C(=C/c1cc(OC)c(OC)c(OC)c1)\C#N
MolPort-019-904-083 0.66 COc1cc(\C=C\C(=O)OCC[N+](C)(C)C)cc(OC)c1O
MolPort-000-784-005 0.66 COc1cc(C=C2C(=O)OC(C)(OC2=O)C(C)(C)C)ccc1O
MolPort-044-216-059 0.66 COc1ccc(C=CC(=O)OCC(=O)COC(=O)C=Cc2ccc(OC)cc2)cc1
MolPort-001-928-233 0.66 CCOC(=O)C(=C\c1ccc2OCOc2c1)\C#N
MolPort-005-220-309 0.66 COc1cc(C=CC(O)=O)ccc1OCC=C
MolPort-001-917-555 0.66 COc1ccc(\C=C2/CCOC2=O)cc1
MolPort-002-645-412 0.66 COc1ccc(\C=C2\CCOC2=O)cc1
MolPort-000-492-046 0.66 COc1cc(\C=C(/C(O)=O)c2ccccc2)ccc1O
MolPort-002-918-603 0.66 COc1cc(OC)cc(\C=C(/C#N)C(=O)OC(C)(C)C)c1
MolPort-000-920-307 0.66 CCOC(=O)C(=C\c1cc(OC)cc(OC)c1)\C#N
MolPort-002-538-524 0.66 COC(=O)Oc1ccc(\C=C\C(=O)OC(C)C)cc1OC(=O)OC
MolPort-004-965-544 0.66 CCCOc1ccc(\C=C(/C#N)C(=O)OCC)cc1OCC
MolPort-000-884-163 0.66 CCOC(=O)C(=C/c1ccc2OCOc2c1)\C#N
MCULE-3201654641 0.66 C(C#N)(C(OC)=O)=CC1C=CC=C(C=1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-7966055382 0.66 C1C2OC2(CC(OC(=O)/C=C/C2C=CC=CC=2)C(C(C2OC2(C)C1)O)C(C)C)C
MCULE-6447164989 0.66 C1(=C(OC)C=CC(/C=C/C(=O)OC)=C1OC)OC
MCULE-9572420523 0.66 C(=O)(OC1=CC=C(C=C1)C)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-4857911106 0.66 C(C#N)(C(OC)=O)=CC1C=C(OC)C(=C(OC)C=1)OC
MCULE-6021519548 0.66 C(=O)(OC1=CC=C(C(C)=C1)C)C=CC1=CC=C(C(OC)=C1)OC
MCULE-1742179073 0.66 C(=O)(OC1=CC(C)=CC(C)=C1)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3628989015 0.66 C1(OCCCCl)C=CC(C=CC(=O)OC)=CC=1OC
MCULE-4415272904 0.66 COC1=C(OC)C(OC)=CC(C=CC(OCC2=CC=CC=C2)=O)=C1
MCULE-1719949673 0.66 C1C2=C(OCCO2)C=C(C=1)/C=C/C(=O)OC
MCULE-8734758113 0.66 C12C=C(C=CC=1OCCO2)C=CC(OC)=O
MCULE-4088914596 0.66 C(OCC)(=O)C(C#N)=C(C1=CC=CC(OC)=C1)C
MCULE-2397684866 0.66 O=C(C=CC1=CC2=C(OCCO2)C=C1)OCC=CC1=CC=CC=C1
MCULE-1952923163 0.66 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OCC
MCULE-3595855195 0.66 C(=O)(OC1=CC=CC=C1)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-2673913201 0.66 C1(OC)=C(OC)C=CC(=C1OC)C=CC(OC)=O
MCULE-9160575633 0.66 CCCOC1=C(OCC)C=C(C=CC(OCCCNC(C)(C)C)=O)C=C1
MCULE-1691776467 0.66 O1COC2C1=CC=C(C=C(C#N)C(OCC(C)C)=O)C=2
MCULE-3201962056 0.66 CCOC1=C(OC)C=CC(C=CC(O)=O)=C1
MCULE-9374195520 0.66 [Li+].C(=O)([O-])C=CC1=CC=C(C=C1)OCCCCC
MCULE-9470535456 0.66 COC(C(C#N)=CC1=CC(OC)=CC=C1)=O
MCULE-5099425428 0.66 C1(OC)C(OC)=CC(/C=C(/C(=O)O)\C(=O)O)=CC=1OC
MCULE-7768753045 0.66 [Na+].C1(OC)=CC(=CC(OC)=C1OC)C=CC([O-])=O
MCULE-1020435052 0.66 CCCOC1=C(OCC)C=C(C=CC(O)=O)C=C1
MCULE-4155152948 0.66 CCOC1=C(OCC(C)C)C=CC(C=CC(O)=O)=C1
MCULE-9574272269 0.66 O=C(/C=C/C1C(O)=C(OC)C=CC=1)O
MCULE-9156764072 0.66 C(O)(=O)C=CC1=CC=C(C(OCC)=C1)OCC
MCULE-3790454540 0.66 C(=CC1=CC=C(C=C1)OC)C(OC)=O
MCULE-8641676482 0.66 [C@H]1(CC2C=C(OC)C(O)=CC=2)CO[C@H](C2C=C(OC)C(O)=CC=2)[C@H]1COC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-6563838758 0.65 C(O)(=O)C=CC1=CC=CC(=C1)OCC(C)C
MCULE-1608251119 0.65 COC1=CC(C(C)=CC(O)=O)=CC=C1
MCULE-2984779968 0.65 C1(C=CCOC(=O)CCCCCCCCCCC)C=CC=CC=1
MCULE-1949029773 0.65 [C@H]1(CO)O[C@@H](OC2CCCCC2O)[C@H](O)[C@@H](OC(/C=C/C2C=CC(O)=C(O)C=2)=O)[C@@H]1O
MCULE-5567401400 0.65 C(C)(C1C(OCC=1C1C=C(OC)C(O)=CC=1)=O)=O
MCULE-1481484439 0.65 C1(C(=O)COC1=O)=CC1=CC(=C(OC)C(OC)=C1)OC
MCULE-2182364021 0.65 COC1=C(O)C=CC(C=CC(OCC(C2=CC=C(C3=CC=CC=C3)C=C2)=O)=O)=C1
MCULE-8376591469 0.65 COC1=C(O)C=CC(C=CC(OCC(C2=CC=C(Br)C=C2)=O)=O)=C1
MCULE-7704731733 0.65 C1(OC)=C(OC)C(OC)=CC(/C=C2/C(=O)OCC/2=O)=C1
MCULE-8577578354 0.65 C(C1=CC=CC=C1)(C(O)=O)=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-5094067546 0.65 [C@H]1(C[C@@](C[C@@H](O)[C@@H]1O)(OC(=O)/C=C/C1C=CC(O)=CC=1)C(=O)O)O
MCULE-9570610110 0.65 C(=CC1=CC=C(C(OC)=C1)OCC1=CC=C(C=C1)C(C)(C)C)C(OC)=O
MCULE-3830308004 0.65 N#CC1C=CC(=CC=1)OC(=O)C=CC1C=CC(=CC=1)OCCCCCCC
MCULE-3399928518 0.65 COC1C(O)=C(OC)C=C(C=CC(OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3OC(C=CC3C=C(OC)C(O)=C(OC)C=3)=O)[C@H](O)[C@@H](O)[C@@H]2O)=O)C=1
MCULE-8360558093 0.65 [C@@H]1(O)[C@@H](CO)O[C@@](CO)(O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C3C=C(OC)C(O)=C(OC)C=3)O2)[C@H]1OC(=O)/C=C/C1C=C(OC)C(O)=C(OC)C=1
MCULE-2174919121 0.65 C1(=C/C2C=CC(=C(OCC)C=2)OCC2C=CC=CC=2)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-6747142232 0.65 C1(C=C(C=CC=1OC)C=CC(OC)=O)OCC1C=CC(=CC=1)C
MCULE-5829202257 0.65 [C@@H]1(O)[C@@H](CO)O[C@@](CO)(O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@H]1OC(=O)/C=C/C1C=C(OC)C(O)=C(OC)C=1
MCULE-9916457884 0.65 C(C#N)(C(OC)=O)=CC1=CC=CC(OCCCC)=C1
MCULE-8949257901 0.65 [C@@H]1(CO)[C@@H](O)[C@H](OC(=O)/C=C/C2C=C(OC)C(O)=C(OC)C=2)[C@](CO)(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O1
MCULE-5374822369 0.65 [C@H]1(COC(=O)/C=C/C2C=C(OC)C(O)=C(OC)C=2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2OC(/C=C/C2C=C(OC)C(O)=C(OC)C=2)=O)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-4999424318 0.65 C1(C=C(C=CC=1OC)C=CC(OC)=O)OCC1=CC=CC2=CC=CC=C12
MCULE-2112618451 0.65 COC1C(O)=C(OC)C=C(C=CC(OC2C(OC3OC(CO)C(O)C(O)C3O)(CO)OC(CO)C2O)=O)C=1
MCULE-7232647509 0.65 C1(=C/C2C=C(OC)C(=C(Br)C=2)O)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-8372222405 0.65 C(=CC1=CC=C(C(OCC)=C1)OCC1=CC=C(C=C1)C)C(OC)=O
MCULE-1445251031 0.65 CC(C1CCC(OC(C(C#N)=CC2=CC=CC=C2)=O)CC1)(C)C
MCULE-1823540360 0.65 C12C=C(C=CC=1OCO2)C=CC(O)=O
MCULE-2604973033 0.65 C(F)(F)(F)C(CCCOC(=O)C=CC1C=CC=CC=1)(F)F
MCULE-1246916047 0.65 C(S)(C(O)=O)=CC1=CC=C(C(OC)=C1)O
MCULE-4602416073 0.65 C12C=C(C=CC=1OCO2)/C=C/C(O)=O
MCULE-6315398758 0.65 C(=C/C1=CC=C(C=C1)OC)(\C(OCC)=O)/C(OCC)=O
MCULE-1543901951 0.65 C(C#N)(=CC1C=CC(=C(OC)C=1)OCCCCCC)C(=O)OC1=CC=C(C=C1OC)C=C(C#N)C(OC)=O
MCULE-6666450423 0.65 COC1=C(C=CC(OCCC2N(C)CCCC2)=O)C=CC=C1
MCULE-7133095910 0.65 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OC(CCC)=O
MCULE-1977309017 0.65 COC1=CC=C(C=CC(OCC#N)=O)C=C1
MCULE-9255771872 0.65 COC1=C(OC)C(OC)=CC(C=CC(OC(C(C2=CC=CC=C2)=O)C)=O)=C1
MCULE-1466642159 0.65 COC1=C(OC)C(OC)=CC(C=CC(OCCCOC2=CC=C(F)C=C2)=O)=C1
MCULE-1193790219 0.65 OC(C=CC1=CC(OC2=CC=CC=C2)=CC=C1)=O
MCULE-9931103507 0.65 C1(O)OC(CO)C(O)C(OC(=O)C)C1OC(=O)/C=C/C1C=CC(O)=CC=1
MCULE-4032135384 0.65 C(=O)(OC1C=CC(=CC=1)C(C)=O)C=CC1C=CC(OCCCCCCCCC)=CC=1
MCULE-1232728643 0.65 C(=O)(OC1C=CC(=CC=1)C(C)=O)C=CC1C=CC(OCCCCCCCC)=CC=1
MCULE-7704947745 0.65 COC1=C(C=CC(OCCCC(C2=CC=CC=C2)=O)=O)C=CC=C1
MCULE-1586428032 0.65 C(=O)(OC1C=CC(=CC=1)C(C)=O)C=CC1C=CC(OCCCCCCC)=CC=1
MCULE-3349318096 0.65 C(=O)(OC1C=CC(=CC=1)C(C)=O)C=CC1C=CC(OCCCCCCCCCCCC)=CC=1
MCULE-1750015387 0.65 C(C#N)(C(OC)=O)=CC1C=CC=C(C=1)OC(CCCC)=O
MCULE-2086683956 0.65 C(=O)(OC1C=CC(=CC=1)C(C)=O)C=CC1C=CC(OCCCCCCCCCC)=CC=1
MCULE-9476594733 0.65 COC1=C(OC)C(OC)=CC(C=CC(OCCOC2=CC=C(C)C=C2)=O)=C1
MCULE-7211263502 0.65 COC1=C(O)C=CC(C=CC(OCC2=CC=C(Br)C=C2)=O)=C1
MCULE-2575447110 0.65 COC1=C(OC)C=C(C=CC(OC2=CC(C(C)C)=CC(C)=C2)=O)C=C1
MCULE-8479676035 0.65 COC1=C(OC)C=C(C=CC(OCCOC2=C(C)C=CC=C2)=O)C=C1
MCULE-2942340898 0.65 COC1=C(O)C=CC(C=CC(OCC2=CC=C(C#N)C=C2)=O)=C1
MCULE-1787476233 0.65 C(=O)(OC1=CC(C)=CC(C)=C1)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-8449117824 0.65 COC1=CC2=C(C=CC(=C2)OC(C=CC2=CC(OC)=C(OC)C(OC)=C2)=O)C=C1
MCULE-5073353925 0.65 C(=O)(OC1=CC=C(C(C)=C1)C)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-1588535827 0.65 C1(OC)C=C(C)C(C=C(C(OCC)=O)C(=O)O)=C(C)C=1
MCULE-1079303912 0.65 C(=O)(OC1=CC=C(C=C1)OC)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-8263713478 0.65 COC(C=CC1=CC(OC)=C(OC(C=CC2=CC(OC)=C(OCC=C)C=C2)=O)C=C1)=O
MCULE-4668282811 0.65 C(O)(C(O)COC(=O)C=CC1C=CC=CC=1)C(O)C(CO)O
MCULE-2164977402 0.65 C(=CC1=CC=C(OC)C=C1)C(OCCCN(C)C)=O
MCULE-9536917683 0.65 C1(C(C)(C)C)=CC(C(C)CCOC(=O)C=CC2C=CC=CC=2)=CC(C(C)(C)C)=C1O
MCULE-2582211613 0.65 C(=CC1=CC=CC(=C1)OCC1=CC=CC=C1)C(OCC)=O
MCULE-9822076405 0.65 [C@]12(C)CCC3C(CCC4C=C(C=CC3=4)OC(=O)C=CC3C=CC=CC=3)C1CCC2OC(=O)C=CC1C=CC=CC=1
MCULE-1707545366 0.65 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OC(CCCOC1C=CC=CC=1OC)=O
MCULE-9838891572 0.65 CC1([C@@H](OC(C=CC2=CC3=C(OCO3)C=C2)=O)C(=O)OC1)C
MCULE-2484651702 0.65 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OC(CCCOC1C=CC(=CC=1)C)=O
MCULE-8260220367 0.65 COC1=CC(C(COC(C=CC2=CC(OC)=C(O)C(OC)=C2)=O)=O)=CC=C1
MCULE-3135146080 0.65 COC1=C(O)C=CC(C=CC(OCC(C2=CC=C(Cl)C=C2)=O)=O)=C1
MCULE-6293515788 0.65 COC1=C(C(COC(C=CC2=CC(OC)=C(O)C=C2)=O)=O)C=CC=C1
MCULE-8276197336 0.65 COC(C=CC1=C(OC)C=CC(OC)=C1)=O
MCULE-1707053941 0.65 COC1=C(O)C=CC(C=CC(OCC(C2=C(C)C=CC(C)=C2)=O)=O)=C1
MCULE-5912352886 0.65 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)OCCOC1C=CC=CC=1
MCULE-7813707636 0.65 C1(=C/C2C=CC(=C(OCC)C=2)OCC2=CC=C(C)C=C2)\C(=O)OC2(OC\1=O)CCCCC2
MCULE-9411063735 0.65 C(/C(OCC)=O)(\C(OCC)=O)=C/C1=CC(OC)=C(C(Br)=C1)O
MCULE-6092782522 0.65 C(/C(C)=O)(\C(C)=O)=C/C1=CC=C(C(OC)=C1)O
MCULE-1646497346 0.65 COC1C(OC)=CC(/C=C/C(O[C@@H]2[C@@](O[C@@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C4C=C(OC)C(O)=C(OC)C=4)=O)O3)(CO)O[C@H](CO)[C@H]2O)=O)=CC=1OC
MCULE-8265274389 0.65 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OC)C=1)OCCOC1=CC=C(C=C1)C
MCULE-7041886835 0.65 C1(=C/C2=CC(OC)=C(C=C2OC)OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-5169734032 0.65 C(C#N)(=CC1C(OC)=C(OC)C=CC=1)C(OCC)=O
MCULE-3616499868 0.65 CCC1=CC=C(C(COC(C=CC2=CC(OC)=CC=C2)=O)=O)C=C1
MCULE-2201620046 0.65 C(=CC1=CC=C(C(OC)=C1)OCC1C=CC=CC=1C)C(OCC=C)=O
MCULE-4965046488 0.65 C1(=C/C2=CC(OC)=CC=C2OC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-9498783535 0.65 C(O)(=O)C=CC1C=CC=C(OCC)C=1
MCULE-2475786053 0.65 O=C(/C=C/C1C=C(OC)C=C(O)C=1)O
MCULE-6007776380 0.65 CCOC(/C(/C(OCC)=O)=C\C1=CC(OC(F)F)=CC=C1)=O
MCULE-5965794951 0.65 BrCCCCOC1C=CC(C=CC(=O)O)=CC=1OC
MolPort-015-163-617 0.65 COc1cc(\C=C2/C(=O)COC2=O)cc(OC)c1OC
MolPort-001-534-484 0.65 CCCCOc1cccc(\C=C(/C#N)C(=O)OC)c1
MolPort-002-932-174 0.65 CCCCCCCOc1ccc(\C=C\C(=O)Oc2ccc(cc2)C#N)cc1
MolPort-000-678-785 0.65 CCCCCOc1ccc(\C=C(\C(O)=O)c2ccccc2)cc1OC
MolPort-006-668-355 0.65 O[C@@H]1C[C@](C[C@@H](O)[C@H]1O)(OC(=O)\C=C\c1ccc(O)cc1)C(O)=O
MolPort-002-821-954 0.65 CCCCC1(C)OC(=O)C(=Cc2ccc(OC)cc2)C(=O)O1
MolPort-004-288-330 0.65 OC(=O)C=Cc1ccc2OCOc2c1
MolPort-019-825-718 0.65 CC(C)COc1cccc(\C=C\C(O)=O)c1
MolPort-008-647-360 0.65 COc1cccc(c1)C(\C)=C\C(O)=O
MolPort-006-022-293 0.65 COc1cccc(c1)C(C)=CC(O)=O
MolPort-002-191-794 0.65 CCCCC1(C)OC(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)C(=O)O1
MolPort-009-217-825 0.65 CCOC(=O)C(=Cc1cccc(OC(F)F)c1)C(=O)OCC
MolPort-019-937-348 0.65 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
MolPort-001-962-118 0.65 CCOc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)ccc1OCc1ccccc1
MolPort-002-329-118 0.65 COc1ccc(OC)c(C=C2C(=O)OC3(CCCCC3)OC2=O)c1
MolPort-002-147-422 0.65 FC(F)(F)C(F)(F)CCCOC(=O)\C=C/c1ccccc1
MolPort-000-147-441 0.65 CCOc1cccc(\C=C\C(O)=O)c1
MolPort-001-766-975 0.65 CCOC(=O)C(=Cc1ccc(OC)cc1)C(=O)OCC
MolPort-001-510-487 0.65 FC(F)(F)C(F)(F)CCCOC(=O)\C=C\c1ccccc1
MolPort-000-147-439 0.65 OC(=O)\C=C\c1ccc2OCOc2c1
MolPort-000-667-866 0.65 CCCC(=O)Oc1ccc(\C=C(/C#N)C(=O)OCC)cc1OCC
MolPort-004-669-251 0.65 COc1cc(C=CC(=O)OC(C)C(=O)c2ccccc2)cc(OC)c1OC
MolPort-011-242-576 0.65 OC(=O)C=Cc1cccc(Oc2ccccc2)c1
MolPort-001-760-440 0.65 OC(=O)\C=C\c1cccc(Oc2ccccc2)c1
MolPort-000-790-853 0.65 CCCCC1(C)OC(=O)C(=Cc2cc(I)c(O)c(OC)c2)C(=O)O1
MolPort-000-782-175 0.65 CCCCC1(C)OC(=O)C(=Cc2cc(Br)c(O)c(OC)c2)C(=O)O1
MolPort-000-669-520 0.65 CCOc1ccc(\C=C\C(=O)Oc2ccc(OC)cc2)cc1OCC
MolPort-002-329-121 0.65 COc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc(Br)c1O
MolPort-002-572-801 0.65 COc1ccc(\C=C\C(=O)OCCCN(C)C)cc1
MolPort-002-528-368 0.65 OCC(O)C(O)C(O)C(O)COC(=O)\C=C\c1ccccc1
MolPort-000-672-202 0.65 CCOC(=O)C(=C\c1ccc(OC(=O)CCCOc2ccc(C)cc2)c(OC)c1)\C#N
MolPort-007-559-859 0.65 COc1ccc(C=C2C(=O)OC(C)(OC2=O)C(C)(C)C)cc1OC
MolPort-002-594-778 0.65 COc1cc(OC)c(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1OC
MolPort-002-327-493 0.65 CCOC(=O)C(=C/c1ccc(OCCOc2ccccc2)c(OC)c1)\C#N
MolPort-002-327-503 0.65 CCOC(=O)C(=C/c1ccc(OCCOc2ccc(C)cc2)c(OC)c1)\C#N
MolPort-002-251-286 0.65 CCOC(=O)C(=Cc1cc(Br)c(O)c(OC)c1)C(=O)OCC
MolPort-002-855-009 0.65 COc1cc(C=C(C(C)=O)C(C)=O)ccc1O
MolPort-002-903-636 0.65 CCOC(=O)C(=C\c1cccc(OC)c1OC)\C#N
MolPort-002-511-050 0.65 C[C@]12CCC3C(CCc4cc(OC(=O)\C=C\c5ccccc5)ccc34)C1CCC2OC(=O)\C=C\c1ccccc1
MolPort-019-937-350 0.65 COc1cc(\C=C\C(=O)OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3OC(=O)\C=C\c3cc(OC)c(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O
MolPort-019-937-159 0.65 OC[C@H]1O[C@@H](OC2CCCCC2O)[C@H](O)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O
MolPort-028-266-010 0.65 CC1(C)COC(=O)[C@@H]1OC(=O)C=Cc1ccc2OCOc2c1
MolPort-044-299-919 0.65 CC(C)(C)C1CCC(CC1)OC(=O)C(=Cc1ccccc1)C#N
MolPort-044-216-009 0.65 COc1ccc(C=CC(=O)OCC#N)cc1
MolPort-021-804-782 0.65 CC(=O)OC1C(O)C(CO)OC(O)C1OC(=O)\C=C\c1ccc(O)cc1
MolPort-044-213-298 0.65 COc1cc(C=CC(=O)OCCCOc2ccc(F)cc2)cc(OC)c1OC
MolPort-044-213-385 0.65 COc1ccccc1C=CC(=O)OCCCC(=O)c1ccccc1
MolPort-044-377-255 0.65 COc1cc(C=CC(=O)OCc2ccc(cc2)C#N)ccc1O
MolPort-044-227-580 0.65 COc1cc(C=CC(=O)OCc2ccc(Br)cc2)ccc1O
MolPort-044-389-956 0.65 COc1ccc(C=CC(=O)OCCOc2ccccc2C)cc1OC
MolPort-044-279-672 0.65 COc1ccc(C=CC(=O)Oc2cc(C)cc(c2)C(C)C)cc1OC
MolPort-044-390-383 0.65 COc1cc(C=CC(=O)OCCOc2ccc(C)cc2)cc(OC)c1OC
MolPort-044-275-181 0.65 COc1ccc2ccc(OC(=O)C=Cc3cc(OC)c(OC)c(OC)c3)cc2c1
MolPort-044-392-756 0.65 COC(=O)C=Cc1ccc(OC(=O)C=Cc2ccc(OCC=C)c(OC)c2)c(OC)c1
MolPort-044-227-476 0.65 COc1cc(C=CC(=O)OCC(=O)c2cc(C)ccc2C)ccc1O
MolPort-039-340-391 0.65 COc1cc(\C=C2\C(=O)COC2=O)cc(OC)c1OC
MolPort-023-221-900 0.65 C1CNCCN1.COc1cc(\C=C\C(O)=O)ccc1O
MolPort-044-227-940 0.65 COc1cccc(c1)C(=O)COC(=O)C=Cc1cc(OC)c(O)c(OC)c1
MolPort-044-227-502 0.65 COc1cc(C=CC(=O)OCC(=O)c2ccccc2OC)ccc1O
MolPort-044-227-584 0.65 COc1cc(C=CC(=O)OCC(=O)c2ccc(Cl)cc2)ccc1O
MolPort-035-816-181 0.65 CCOc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)ccc1OCc1ccc(C)cc1
MolPort-046-684-020 0.65 COc1cc(\C=C\C(=O)OC2C(O)C(CO)OC2(CO)OC2OC(CO)C(O)C(O)C2O)cc(OC)c1OC
MolPort-039-338-857 0.65 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)\C=C/c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-039-338-855 0.65 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)\C=C\c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-039-338-803 0.65 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)\C=C\c6ccc(O)cc6)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MolPort-039-338-856 0.65 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)\C=C/c6ccc(O)cc6)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MolPort-044-388-199 0.65 CCc1ccc(cc1)C(=O)COC(=O)C=Cc1cccc(OC)c1
MolPort-044-559-799 0.65 COc1cc(O)cc(\C=C\C(O)=O)c1
MolPort-046-688-825 0.65 COC(=O)\C=C\c1ccc(OCc2ccccc2)c(O)c1
MolPort-044-259-568 0.65 COc1ccccc1C=CC(=O)OCCC1CCCCN1C
MolPort-046-684-149 0.65 COc1cc(\C=C\C(=O)OC[C@H]2O[C@H](O[C@@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3OC(=O)\C=C\c3cc(OC)c(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O
MolPort-039-339-136 0.65 COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
MolPort-039-339-167 0.65 COc1cc(\C=C\C(=O)OC[C@H]2O[C@H](O[C@@]3(CO)O[C@@H](CO)[C@H](O)[C@H]3OC(=O)\C=C\c3cc(OC)c(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O
MolPort-039-338-500 0.65 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(COC(=O)\C=C/c6ccc(O)cc6)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
MolPort-044-227-478 0.65 COc1cc(C=CC(=O)OCC(=O)c2ccc(Br)cc2)ccc1O
MolPort-044-227-479 0.65 COc1cc(C=CC(=O)OCC(=O)c2ccc(cc2)-c2ccccc2)ccc1O
MolPort-000-679-610 0.64 COc1cc(\C=C\C(O)=O)ccc1OC(C)=O
MolPort-001-682-447 0.64 CCOC(=O)C(=C\c1ccc(OCc2ccccc2)c(OC)c1)\C#N
MolPort-006-827-338 0.64 COC(=O)C(\CC(O)=O)=C/c1ccc2OCOc2c1
MolPort-002-237-472 0.64 CCCCC1(C)OC(=O)C(=Cc2cc(OC)c(OC)cc2OC)C(=O)O1
MolPort-005-945-355 0.64 COc1cc(\C=C\C(=O)O[C@H](C(O)=O)[C@](O)(Cc2ccc(O)cc2)C(O)=O)ccc1O
MolPort-002-837-329 0.64 CCCCCCOc1cc(\C=C\C(O)=O)c(OCCCCCC)cc1\C=C\C(O)=O
MolPort-000-654-577 0.64 COc1ccc(\C=C\C(=O)Oc2c(C)cccc2C)cc1OC
MolPort-006-755-318 0.64 COC(=O)C(=C/c1cccc(Oc2ccccc2)c1)\C#N
MolPort-009-021-528 0.64 COc1ccc(Br)cc1C=CC(=O)OC1CCCCC1=O
MolPort-002-186-187 0.64 COc1ccc(\C=C\C(=O)OCC(=O)c2ccc(Br)cc2)cc1OC
MolPort-001-970-708 0.64 COc1ccc(\C=C\C(=O)OCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1OC
MolPort-009-022-115 0.64 COc1cc(CCC(=O)OCC=Cc2ccccc2)cc(OC)c1OC
MolPort-000-735-913 0.64 [Cl-].COc1ccc(\C=C\C(=O)OCCC[NH+](C)C)cc1
MolPort-015-099-015 0.64 CCCOc1c(OC)cc(\C=C\C(O)=O)cc1OC
MolPort-001-962-145 0.64 COc1cc(C=C2C(=O)OC3(CCCC3)OC2=O)ccc1OCc1ccccc1
MolPort-002-938-676 0.64 CCOC(=O)C(=C\c1ccc(OCCOc2cccc(C)c2)c(OC)c1)\C#N
MolPort-000-651-248 0.64 CCCCCOc1ccc(\C=C\C(=O)Oc2cc(C)c(Cl)c(C)c2)cc1OC
MolPort-000-678-784 0.64 COc1ccc(\C=C(\C(O)=O)c2ccccc2)cc1OC
MolPort-004-965-532 0.64 CCCOc1ccc(\C=C(/C#N)C(=O)OC)cc1OCC
MolPort-000-676-218 0.64 CCCCOc1ccc(\C=C(/C#N)C(=O)Oc2cccc(\C=C(/C#N)C(=O)OCC)c2)cc1
MolPort-002-867-817 0.64 CCCCOC(=O)C1=Cc2cccc(OC)c2OC1
MolPort-001-740-638 0.64 COc1ccc(CCO[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)\C=C\c3ccc(O)c(OC)c3)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1O
MolPort-001-011-485 0.64 CCOC(=O)C(=C\c1ccc(OC)cc1)\C#N
MolPort-000-654-060 0.64 CCOC(=O)C(=C/c1ccc(OC)cc1)\C#N
MolPort-002-918-370 0.64 COc1ccc(\C=C(/C#N)C(=O)OC(C)(C)C)cc1
MolPort-003-912-494 0.64 CCOC(=O)C(=Cc1ccc(OC)cc1)C#N
MolPort-002-046-133 0.64 COc1ccc(\C=C(/S)C(O)=O)cc1OC
MolPort-002-911-790 0.64 CCOC(=O)C(=C\c1ccc(OC)c(OCc2ccccc2)c1)\C#N
MolPort-004-365-068 0.64 COc1cc(OC)cc(C=CC(O)=O)c1
MolPort-011-276-667 0.64 COc1ccc(\C=C(/C(O)=O)c2ccccc2)cc1OC
MolPort-000-147-556 0.64 COc1cc(OC)cc(\C=C\C(O)=O)c1
MolPort-000-743-965 0.64 [I-].COc1ccccc1\C=C\C(=O)OC[C@@H]1CCC[N+]2(C)CCCC[C@H]12
MolPort-044-214-110 0.64 O=C(OCc1ccccc1)C=Cc1ccc2OCOc2c1
MolPort-002-237-616 0.64 CCOc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)c2ccccc12
MolPort-003-708-258 0.64 O=C(OCCCc1ccccc1)\C=C\c1ccccc1
MolPort-002-857-362 0.64 CCCCCCOc1ccc(\C=C\C(=O)Oc2ccc(CC(C)CC)cc2)cc1
MolPort-002-886-914 0.64 CCOC(=O)\C=C\c1ccc(O)cc1
MolPort-001-786-889 0.64 COc1cc(\C=C\C=O)ccc1O
MolPort-019-937-496 0.64 COc1cc(CCO[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](OC(=O)\C=C\c3ccc(O)c(OC)c3)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)ccc1O
MolPort-002-242-210 0.64 Cl.COc1ccc(\C=C\C(=O)OCCCN(C)C)cc1
MCULE-7395128935 0.64 C1(OC)C=C(/C=C/C=O)C=CC=1O
MCULE-2959640396 0.64 C(=CC1C=CC(=CC=1)O)C(OCC)=O
MCULE-2157553829 0.64 C(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-9830754169 0.64 C(C1=CC=CC=C1)(C(O)=O)=CC1=CC=C(C(OC)=C1)OC
MCULE-6094055690 0.64 C(OC)(=O)C=CC1=CC=CC(O)=C1
MCULE-2249067422 0.64 C1C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-7066392123 0.64 COC(C(C#N)=CC1=CC(OC2=CC=CC=C2)=CC=C1)=O
MCULE-4342206647 0.64 COC(C(C1=CC=CC=C1)=CC1=CC(OC)=CC=C1)=O
MCULE-7151204903 0.64 [N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC=CC=1OC)C
MCULE-8474823297 0.64 N12CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC=CC=1OC
MCULE-9063095459 0.64 C1(Cl)C(C)=CC(=CC=1C)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-1633460067 0.64 C(CC(O)=O)(C(OC)=O)=CC1=CC=C2C(OCO2)=C1
MCULE-6395759770 0.64 C1(=CC=C(C=C1OC)C=CC(O)=O)OC(C)=O
MCULE-4775602483 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OCC1=CC=CC=C1
MCULE-4971680179 0.64 C12OCOC1=CC(/C=C(\C(=O)OC)/CC(O)=O)=CC=2
MCULE-4162896206 0.64 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCC1=CC=C(C=C1)Br
MCULE-4405991617 0.64 C1C=C(CC(C(=O)O)(O)C(C(O)=O)OC(=O)/C=C/C2C=C(OC)C(O)=CC=2)C=CC=1O
MCULE-7818366406 0.64 C1=CC(O)=C(OC)C=C1/C=C/C(O[C@@H]([C@@](CC1C=CC(O)=CC=1)(O)C(O)=O)C(=O)O)=O
MCULE-8365595681 0.64 COC1=C(O)C=CC(C=CC(OCCOC2=CC=C(Br)C=C2)=O)=C1
MCULE-9488760771 0.64 COC1=C(OC)C(OC)=CC(C=CC(OCC(C2=CC=C(C3CCCCC3)C=C2)=O)=O)=C1
MCULE-8231455999 0.64 C1(=CC(OCCCCCC)=C(C=C1OCCCCCC)C=CC(O)=O)C=CC(O)=O
MCULE-3824591599 0.64 COC1=C(OCC#N)C=CC(C=CC(OCC(F)F)=O)=C1
MCULE-8269551776 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OC(CCCOC1C=CC=C(C)C=1)=O
MCULE-8248944935 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OC(CCCOC1=CC=C(C=C1)C)=O
MCULE-4752803167 0.64 C1(=C(C)C=CC=C1C)OC(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3325119200 0.64 [C@H]1(CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O[C@@H](OCCC2C=C(O)C(O)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-7728513655 0.64 C(=O)(C=CC1C=CC(=C(OCC)C=1)OCC)OC1=CC=CC=C1OCC
MCULE-3932519997 0.64 CCOC1=CC=C(OC(C=CC2=CC(OC)=C(OC)C(OC)=C2)=O)C=C1
MCULE-8389883392 0.64 C1(OC)C(OC)=CC(=CC=1OC)C=C(CC=C)C(O)=O
MCULE-7877960505 0.64 O=C(C=CC1C=C(OC)C(O)=CC=1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCC2C=C(O)C(OC)=CC=2)O[C@@H]1CO
MCULE-1426369877 0.64 COC1=C(C=CC(OC2C(=O)CCCC2)=O)C=C(Br)C=C1
MCULE-4348344529 0.64 CCOC1=C(OC)C(Cl)=CC(C=CC(OC(C(C)=O)C)=O)=C1
MCULE-1969178245 0.64 CCCOC1=C(OC)C=C(C=CC(O)=O)C=C1OC
MCULE-1356487669 0.64 COC1=C(O)C=CC(C=CC(OCC(C2=CC=C(OC(F)F)C=C2)=O)=O)=C1
MCULE-5967144761 0.64 O=C(C1=CC=CC=C1)COC(C=CC1=CC2=C(OCO2)C=C1)=O
MCULE-7248660439 0.64 COC1=C(O)C=CC(C=CC(OCC(C2=CC=C(F)C=C2)=O)=O)=C1
MCULE-7628774303 0.64 C(C1=CC=CC(OC)=C1Cl)=CC(OCC)=O
MCULE-8017261569 0.64 C(=CC1=CC=C(OC)C=C1)C(OCCCN(C)C)=O.Cl
MCULE-8940618497 0.64 C(C#N)(=CC1=CC=C(C=C1)OC)C(OCCC)=O
MCULE-6648880707 0.64 C(=O)(OCC(=O)C1C=CC(=CC=1)Br)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3535154294 0.64 C1(=C/C2C=CC(=C(OC)C=2)OCC2C=CC=CC=2)\C(=O)OC2(OC\1=O)CCCC2
MCULE-8819151007 0.64 CCOC(C(C#N)=CC1=CC2=C(OCCO2)C=C1)=O
MCULE-5627062429 0.64 COC1=C(O)C(Cl)=CC(C=C(C(OC(C)C)=O)C#N)=C1
MCULE-3573984728 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OCCOC1C=CC=C(C)C=1
MCULE-8464929823 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OCC)=C1)OCCOC1C=CC(=CC=1)C
MCULE-8879920065 0.64 C(C#N)(C(OCC)=O)=CC1C=CC(=C(OCC)C=1)OCCOC1C=CC=CC=1
MCULE-1469764116 0.64 COC1=C(O)C=C(C=C(C(O)=O)C#N)C=C1
MCULE-9748274284 0.64 C(O)(=O)C=CC1=CC(OC)=C(O)C(C=CC2=CC=C(O)C(OC)=C2)=C1
MCULE-8082600700 0.64 C(=O)(OC1=CC=C(C=C1)CC(C)CC)C=CC1=CC=C(C=C1)OCCCCCC
MCULE-3538877379 0.64 COC(C=CC1=CC(OC)=C(OCC(COC2=CC=C(C(C)(C)C)C=C2)O)C=C1)=O
MCULE-3752700032 0.64 C(COC(=O)C=CC1=CC=C(C(OC)=C1)OCC1C=CC=CC=1)#C
MCULE-5851829053 0.64 N(=O)(=O)C1=CC=C(C=C1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCCC
MCULE-5928432180 0.64 C(=CC1=CC=C(C=C1)OC)(C(OC)=O)C(O)=O
MCULE-1074170945 0.64 C(=CC1C=CC=CC=1)C(OCCCC1=CC=CC=C1)=O
MCULE-4776289378 0.64 C1(=C/C2=CC=C(C3=CC=CC=C23)OCC)/C(=O)OC2(OC/1=O)CCCCC2
MCULE-7085236706 0.64 [N+]12(CCCC[C@]1([H])[C@@H](CCC2)COC(=O)C=CC1C=CC=CC=1OC)C.[I-]
MCULE-3209055875 0.64 COC(C=CC1=CC(OC)=C(OCC2=C(C)C=CC=C2)C=C1)=O
MCULE-7412560834 0.64 C(C#N)(C(OC)=O)=CC1=CC=C(C(OC)=C1)OC(=O)C=CC1=CC=C(C(OC)=C1)OCCCCC
MCULE-5814459985 0.64 [C@H]1(CC2C=C(OC)C(O)=C(OC)C=2)CO[C@H](C2C=C(OC)C(O)=C(OC)C=2)[C@H]1COC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-3333629868 0.64 C(O)(=O)/C=C/C1C=C(OC)C=C(OC)C=1
MCULE-2740776573 0.64 C(O)(=O)C=CC1C=C(OC)C=C(OC)C=1
MCULE-9732913829 0.64 C=CCOC(C(C#N)=CC1=CC2=C(OCCO2)C=C1)=O
MCULE-2548689474 0.64 C(C#N)(=CC1C=CC(=CC=1)OCCCC)C(=O)OC1=CC=CC(=C1)C=C(C#N)C(OCC)=O
MCULE-6715486217 0.64 C1(=C(C=CC(C=C(C)C(=O)O)=C1)OCC1C=CC=CC=1)OC
MCULE-1681734971 0.64 C(C#N)(=CC1C=CC(=CC=1)OCCCCCCCCCC)C(O)=O
MCULE-6964207776 0.64 CCOC(C(C#N)=CC1=CC(OCC2=CC=CC=C2)=C(OC)C=C1)=O
MCULE-3199241028 0.64 COC1=C(OC)C(C=CC(OC2C(=O)OCC2)=O)=CC=C1
MCULE-2530974253 0.64 CCCOC1=C(OCC)C=C(C=CC(OCC(N)=O)=O)C=C1
MCULE-6051829174 0.64 C(C#N)(=CC1C=CC(=CC=1)OC)C(OCC)=O
MCULE-4454532664 0.64 CC1C(OC(C=CC2=CC3=C(OCC3)C=C2)=O)(C)C1
MCULE-6096090529 0.64 COC(C=CC1=CC2=C(C=C(C=C2)OC)C=C1)=O
MCULE-8699918665 0.64 C(S)(C(O)=O)=CC1=CC=C(C(OC)=C1)OC
MCULE-4832261610 0.64 C(OC(C)C)(=O)C=CC1C=CC(=C(OC)C=1)OCC1C=CC(=CC=1)Cl
MCULE-4859163201 0.64 C1(=CC=C(OC)C=C1)C=C(C#N)C(=O)OC(C)(C)C
MCULE-8339872907 0.64 [C@H]1(COC(=O)/C=C/C2C=CC(O)=C(OC)C=2)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H]1O
MCULE-5917405544 0.64 [C@]1(O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]1O)([H])O[C@H]1[C@H](OC(=O)/C=C/C2C=CC(=C(C=2)OC)O)[C@@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)O[C@@H](OCCC2=CC=C(OC)C(O)=C2)[C@@H]1O
MCULE-8699788584 0.64 [C@H]1(CO[C@H]2[C@H](O)[C@@H](O)[C@@H](O)CO2)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-4530938955 0.64 [C@@H]1(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](OCCC2=CC=C(OC)C(O)=C2)O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@H]1OC(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-2142825496 0.64 [C@H]1(CO)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-2326970395 0.64 C1(COC2C(=CC=CC=2OC)C=1)C(OCCCC)=O
MCULE-7748244499 0.64 [C@H]1(CO)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](O)[C@H](C)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MCULE-1957814872 0.64 C[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@H](O[C@H]2[C@H](O)[C@@H](COC(/C=C/C3C=C(OC)C(O)=CC=3)=O)O[C@@H](OCCC3=CC=C(O)C(OC)=C3)[C@@H]2O)O1
MCULE-3929917911 0.64 O([C@@H]1[C@H](O[C@@H](OCCC2C=CC(OC)=C(O)C=2)[C@H](O)[C@H]1O[C@]1([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)CO[C@H]1[C@@H]([C@@H](O)[C@@H](O)[C@@H](CO)O1)O)C(=O)/C=C/C1C=CC(O)=C(OC)C=1
MolPort-006-385-283 0.64 CCOC(=O)C(=C\c1ccc(OCCOc2ccc(C)cc2)c(OCC)c1)\C#N
MCULE-7811413853 0.64 [C@H]1(CO)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MolPort-044-637-456 0.64 COc1cc(\C=C\C(=O)OC(C(O)=O)C(O)(Cc2ccc(O)cc2)C(O)=O)ccc1O
MCULE-4441531087 0.64 C(C#N)(C(OCC)=O)=CC1=CC=C(C(OC)=C1)OC(CCCOC1=CC=C(C=C1)OC)=O
MolPort-042-624-479 0.64 COc1cc(\C=C\C(=O)O[C@@H]2[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)ccc1O
MCULE-8909830350 0.64 [C@H]1(CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O[C@@H](OCCC2C=C(O)C(OC)=CC=2)[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H]1OC(=O)/C=C/C1C=CC(O)=C(OC)C=1
MolPort-044-392-090 0.64 CCOc1ccc(OC(=O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1
MCULE-1016258801 0.64 CCOC1=C(OC2CCCC2)C(C=CC(O)=O)=CC=C1
MolPort-046-693-641 0.64 COc1cc(\C=C(/CC=C)C(O)=O)cc(OC)c1OC
MCULE-3747665346 0.64 O=C(C=CC1=CC2=C(OCO2)C=C1)OCC1=CC=CC=C1
MolPort-044-227-531 0.64 COc1cc(C=CC(=O)OCCOc2ccc(Br)cc2)ccc1O
MCULE-2241132632 0.64 C(C#N)(C(OC)=O)=CC1=CC=C2C(OCO2)=C1
MolPort-044-261-682 0.64 COc1cc(C=CC(=O)OCC(F)F)ccc1OCC#N
MCULE-1907119255 0.64 C(C#N)(C(OC)=O)=CC1=CC=C(C(OCC)=C1)OCCC
MolPort-044-390-373 0.64 COc1cc(C=CC(=O)OCC(=O)c2ccc(cc2)C2CCCCC2)cc(OC)c1OC
MolPort-027-639-261 0.64 CCOC(=O)C=Cc1ccc(O)cc1
MolPort-028-748-876 0.64 COc1cc(C=CC(O)=O)ccc1OC(C)=O