SANC00323 7-O-Methyleucomol




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-046-761-034 1 COC1=CC=C(C[C@]2(O)COC3=CC(OC)=CC(O)=C3C2=O)C=C1
MolPort-046-158-465 0.99 COC1=CC=C(C[C@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-046-790-523 0.98 OC1=CC=C(C[C@@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-046-790-516 0.88 COC1=CC(O)=C2C(=O)C(CC3=CC=C(O)C=C3)COC2=C1
MCULE-1545228810 0.88 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MolPort-039-052-502 0.88 COC1=CC=C(C=C1)[C@H]1OC2=CC(OC)=CC(OC)=C2C(=O)[C@@H]1O
MolPort-046-158-526 0.87 COC1=C2C(=O)[C@H](O)[C@H](OC2=CC(O)=C1)C1=CC=CC=C1
MCULE-6745304759 0.87 C1C(O)=C2C(C(COC2=CC=1O)CC1C=CC(=CC=1)OC)=O
MCULE-4510679729 0.87 C1C(OC)=C2C(=O)C[C@@H](C)OC2=C(C=1O)CCO
MCULE-3159000697 0.87 C1(OC)C=C2O[C@@H]([C@@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MolPort-046-761-031 0.87 COC1=CC=C(C[C@@H]2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-019-937-209 0.87 COC1=CC=C(CC2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-001-739-248 0.87 COC1=C2C(=O)C[C@@H](C)OC2=C(CCO)C(O)=C1
MolPort-001-740-729 0.87 COC1=CC(O)=C2C(=O)[C@H](O)[C@H](OC2=C1)C1=CC=C(O)C=C1
MCULE-2154315081 0.86 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-1736405258 0.86 C1(OC)C=CC(CC2COC3C=C(O)C=CC=3C2=O)=CC=1
MolPort-019-937-486 0.86 COC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-035-705-988 0.86 OC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1
MolPort-001-741-626 0.85 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=CC=C1
MolPort-046-790-524 0.85 CC1=C(O)C=C2OC[C@@H](CC3=CC=C(O)C=C3)C(=O)C2=C1O
MolPort-027-720-890 0.85 COC1=CC=C(C[C@@H]2COC3=C(C2=O)C(O)=C(C)C(O)=C3C)C=C1
MCULE-4560358638 0.85 C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-4463093454 0.85 C12C(O)=CC(O)=CC=1O[C@H](C1C=CC=CC=1)[C@@H](O)C2=O
MCULE-6672284700 0.85 C1(O)C(C)=C2OC[C@@H](CC3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1C
MCULE-2373585148 0.85 CC1C(O)=C(C)C2OCC(CC3C=CC(OC)=CC=3)C(=O)C=2C=1O
MCULE-8240919679 0.85 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-3029164834 0.85 C1(O)C=C2O[C@H]([C@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MCULE-6429597192 0.85 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-002-486-330 0.85 OC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-001-741-294 0.85 O[C@H]1[C@@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MolPort-016-638-406 0.85 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-397 0.84 COC1=C(C)C(O)=C2C(=O)[C@H](O)[C@H](OC2=C1)C1=CC=C(O)C=C1
MCULE-5733387532 0.84 C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-9182612724 0.84 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=CC=1
MCULE-5559057559 0.84 C1(O)C=C2O[C@H]([C@@H](C(C2=CC=1)=O)O)C1C=CC(O)=CC=1
MCULE-1335950835 0.84 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(O)=O
MolPort-039-142-001 0.84 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-005-945-530 0.84 O[C@H]1[C@@H](OC2=CC(O)=CC=C2C1=O)C1=CC=C(O)C=C1
MolPort-002-507-573 0.83 CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2O
MCULE-3666139069 0.83 C12=CC(OCCOC3=CC=C4C(OC(CC4=O)(C)C)=C3)=CC=C1C(CC(C)(C)O2)=O
MCULE-5089786365 0.83 C12C(OC)=CC(=CC=1OC(C)(C)CC2=O)OC
MolPort-002-507-621 0.82 CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2
MolPort-005-944-003 0.82 COC1=C2C(=O)C[C@@H](C)OC2=C2CCOC2=C1
MolPort-001-739-249 0.82 CCC1=C2O[C@H](C)CC(=O)C2=C(OC)C=C1O
MolPort-019-937-045 0.82 COC1=CC(OC)=C2C(=O)CC(OC2=C1CC(O)C(C)(C)O)C1=CC=CC=C1
MolPort-001-742-736 0.82 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=CC=C1O
MolPort-019-937-165 0.82 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=CC=C1
MCULE-4553065305 0.82 C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O
MCULE-9278940968 0.82 C1C(=C2C(=O)C[C@H](OC2=C2CCOC=12)C)OC
MCULE-2924473141 0.82 C1C(=C2C(=C(C=1O)CC)O[C@H](C)CC2=O)OC
MCULE-3714829206 0.82 C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-5242974703 0.82 C1(OC)C(CC(O)C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-6286398411 0.82 C1(O)C=C2O[C@H](C3C=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-8143016945 0.82 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OC
MCULE-2851603971 0.82 C1(O)C=C2OCC(CC3C=CC(OC)=C(O)C=3)C(=O)C2=C(O)C=1
MCULE-1252928951 0.82 Cl.C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O
MolPort-002-126-253 0.82 COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-029-887-061 0.82 COC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1O
MolPort-000-855-697 0.82 Cl.CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2
MolPort-035-683-152 0.81 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=C(O)C=C1
MolPort-002-507-620 0.81 COC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MCULE-1604093945 0.81 C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6367958739 0.81 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(OC)=O
MCULE-7123585792 0.81 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(C1C=CC=CC=1)=O
MCULE-2940029331 0.81 C12C=C(OCCC)C=CC=1C(CC(C)(C)O2)=O
MCULE-5357665740 0.81 C12=CC(OC)=CC=C1C(CC(C)(C)O2)=O
MCULE-1173100593 0.81 C12C=C(OC)C=CC=1C(CC(C)O2)=O
MolPort-000-693-539 0.81 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=CC=C1)C=C2O
MolPort-002-855-621 0.81 CCCOC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-002-904-439 0.81 COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-035-706-506 0.80 OC1=CC2=C(C=C1)C(=O)C(CC1=CC(O)=C(O)C=C1)CO2
MolPort-001-740-727 0.80 COC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC(O)=C(O)C=C1
MCULE-7447091722 0.80 O=C1C2C(OC)=C(C(=O)C)C(O)=CC=2OC(C)(C)C1
MCULE-4391957723 0.80 C1(O)C=C2OCC(CC3C=CC(O)=C(O)C=3)C(=O)C2=CC=1
MCULE-1480766301 0.80 C1(OC)=CC(O)=C2C([C@@H]([C@@H](C3C=CC(O)=C(O)C=3)OC2=C1)O)=O
MCULE-5732404629 0.80 C12OC(CC(=O)C1=CC=C(OC)C=2C)(C)C
MCULE-8793789355 0.80 CC(OCC(COC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)O)C
MCULE-8224104004 0.80 C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6930739422 0.80 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1=CC=C(C=C1)O)OC/C=C(\C)/C
MCULE-1219453843 0.80 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)O
MolPort-039-079-516 0.80 CC(C)OCC(O)COC1=CC=C2C(=O)CC(C)(C)OC2=C1
MolPort-002-910-535 0.80 COC1=C(C)C2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-005-909-341 0.80 COC(=O)COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-035-706-517 0.80 COC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC(O)=C(OC)C=C1
MolPort-001-742-561 0.80 CC(C)=CCOC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC=C(O)C=C1
MolPort-002-054-240 0.80 CC1(C)CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-035-705-989 0.79 COC1=C(O)C2=C(C(O)=C1)C(=O)C(CC1=CC=C(O)C=C1)CO2
MCULE-4254870575 0.79 C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2809167723 0.79 C12=C(O)C=C(C=C1OC(C(O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-4871721304 0.79 C12C(O)=CC(=CC=1O[C@H]([C@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2692728789 0.79 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2394173874 0.79 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2296975795 0.79 C12=C(O)C=C(C=C1O[C@@H]([C@@H](O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-2567986775 0.79 O1C2=CC(=CC(=C2C([C@H]([C@@H]1C1=CC=C(C(=C1)O)O)O)=O)O)O
MCULE-6698156528 0.79 O1C2=CC(=CC(=C2C([C@@H]([C@@H]1C1=CC(=C(C(=C1)O)O)O)O)=O)O)O
MCULE-7026035805 0.79 C1(OC)C(O)=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-3921944108 0.79 O=C1C2C(OC)=C(C=O)C(O)=CC=2OC(C)(C)C1
MCULE-4912537449 0.79 C1(CO)(CC2=CC=C(C=C2)OC)COC2C(=CC=CC=2)C1=O
MCULE-1856015315 0.79 O(C)C1C=CC([C@H]2OC3=CC(O)=CC(O)=C3C([C@@H]2O)=O)=CC=1O
MCULE-2327386216 0.79 C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-002-818-093 0.79 COC1=CC=C(CC2(CO)COC3=CC=CC=C3C2=O)C=C1
MolPort-001-741-843 0.79 COC1=C(O)C=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-009-684-203 0.79 O[C@H]1[C@@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-001-740-800 0.79 OC1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC(O)=C(O)C(O)=C1
MolPort-001-740-892 0.79 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-003-850-396 0.79 O[C@@H]1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-002-718-925 0.79 OC1C(OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC(O)=C(O)C=C1
MolPort-006-069-341 0.79 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC(O)=C(O)C(O)=C1
MolPort-022-446-258 0.79 COC1=CC=CC2=C1C(=O)CC(C)(C)O2
MolPort-000-856-026 0.79 CC1(C)CC(=O)C2=C(O1)C=C(O)C=C2
MolPort-020-366-394 0.78 COC1=CC(OC)=C2C(=O)CCOC2=C1
MolPort-006-417-676 0.78 OC1COC2=CC=CC=C2C1=O
MolPort-006-668-453 0.78 CC(C)(O)C1CC2=C(O1)C=CC(C(=O)CCC1=CC=CC=C1)=C2O
MolPort-039-141-839 0.78 CC1=C(O)C2=C(O[C@@H]([C@@H](O)C2=O)C2=CC(O)=C(O)C(O)=C2)C=C1O
MolPort-005-945-431 0.78 CC1=C(O)C=C2O[C@H]([C@H](O)C(=O)C2=C1O)C1=CC(O)=C(O)C=C1
MolPort-005-944-657 0.78 CC1=C(O)C=C2O[C@H]([C@H](O)C(=O)C2=C1O)C1=CC(O)=C(O)C(O)=C1
MolPort-039-141-838 0.78 CC1=C(O)C2=C(O[C@@H]([C@@H](O)C2=O)C2=CC(O)=C(O)C=C2)C=C1O
MCULE-1941541843 0.78 C12C=C(O)C=CC=1C(CC(C)(C)O2)=O
MCULE-1362714791 0.78 O=C1C2C(=CC=CC=2OC(C)(C)C1)OC
MCULE-2962679821 0.78 OC1C2C(=O)CC(OC=2C=C(O)C=1C(=O)C)(C)C
MCULE-1588072136 0.78 C12C(CCOC=1C=C(OC)C=C2OC)=O
MCULE-5411478435 0.78 OC1C(=O)C2=C(C=CC=C2)OC1
MCULE-4911952817 0.78 C12OC(C(O)(C)C)CC=1C(O)=C(C(=O)CCC1C=CC=CC=1)C=C2
MCULE-8793012880 0.78 C(C)(=O)OC1=CC2=C(C(C(C(C)O2)C(C)=O)=O)C=C1
MCULE-3324744620 0.78 [C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@]1(O)C
MCULE-6991857034 0.78 OC1C=CC([C@@H]2OC3=CC(O)=C(C)C(O)=C3C([C@H]2O)=O)=CC=1O
MCULE-1338747805 0.78 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-4817576208 0.78 C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-4812868362 0.78 OC1C(O)=CC([C@@H]2OC3C(C([C@H]2O)=O)=C(O)C(C)=C(O)C=3)=CC=1O
MCULE-9497505068 0.78 C12OC(C)(C)CC(=O)C1=CC=C(O)C=2C
MCULE-2605725094 0.78 C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MCULE-3493265138 0.78 C12C(OC)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(OC)C=1)OC)OC
MCULE-3441155287 0.78 C12OC(CC(=O)C=1C=CC(OCC(=O)C)=C2C)(C)C
MCULE-9634821184 0.78 O1C2C=C(O)C=CC=2C([C@H](O)[C@H]1C1=CC(O)=C(C(O)=C1)O)=O
MCULE-3231582881 0.78 [C@H]1([C@@H](O)C(C2C=CC(O)=CC=2O1)=O)C1C=CC(O)=C(O)C=1
MCULE-5340165807 0.78 C1(O)C=C2OC(C(C(=O)C2=CC=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-5665116242 0.78 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MCULE-6464026618 0.78 C12C=CC(OCC(=O)OCC)=CC=1OC(CC2=O)(C)C
MCULE-6480805780 0.78 C1(=O)C2=CC=CC=C2OC(C2C=CC=CC=2)C1O
MCULE-7275500281 0.78 C1(OC)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC=CC=1
MCULE-2295691776 0.78 [C@@H]1([C@H](O)C(C2C=CC=CC=2O1)=O)C1C=CC=CC=1
MCULE-6709417192 0.78 C(#N)COC1=CC2OC(C)(C)CC(=O)C=2C=C1
MolPort-000-145-684 0.78 CC1=C(O)C=CC2=C1OC(C)(C)CC2=O
MolPort-035-705-961 0.78 COC1=C(O)C=C(C=C1O)[C@H]1OC2=CC(O)=CC=C2C(=O)[C@@H]1O
MolPort-001-842-621 0.78 CC(=O)COC1=C(C)C2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-002-718-926 0.78 COC1=CC2=C(C(=O)C(O)C(O2)C2=CC(OC)=C(OC)C=C2)C(OC)=C1
MolPort-000-447-968 0.78 OC1C(OC2=C(C=CC=C2)C1=O)C1=CC=CC=C1
MolPort-003-665-793 0.78 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC(O)=C(O)C(O)=C1
MolPort-001-740-717 0.78 COC1=CC(OC)=C2C(=O)CC(OC2=C1)C1=CC=CC=C1
MolPort-002-915-223 0.78 CCOC(=O)COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-046-790-389 0.78 COC1=CC(OC)=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-006-069-167 0.78 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC(O)=C(O)C=C1
MolPort-002-903-721 0.78 O[C@H]1[C@@H](OC2=C(C=CC=C2)C1=O)C1=CC=CC=C1
MolPort-038-966-001 0.77 CC1(C)CC(=O)C2=CC=C(OCC(O)CC(F)(F)F)C=C2O1
MolPort-035-683-202 0.77 CC1(C)CCC2=C3O[C@@H](CC(=O)C3=C(O)C=C2O1)C1=CC=CC=C1
MolPort-019-937-108 0.77 COC1=C2C(=O)CC(OC2=C2C3C(OC2=C1)C3(C)C)C1=CC=CC=C1
MCULE-8501275024 0.77 CC1(OC2=C(C=CC(=C2)OCC(CC(F)(F)F)O)C(=O)C1)C
MCULE-8604836333 0.77 C12OC(C)(C)CCC1=C1O[C@H](C3C=CC=CC=3)CC(=O)C1=C(O)C=2
MCULE-5444072692 0.77 OC1C2C(=O)CC3(OC=2C=C(O)C=1)CC3
MCULE-2108662486 0.77 C12OC3C(C)(C)C3C1=C1OC(C3C=CC=CC=3)CC(C1=C(OC)C=2)=O
MCULE-1231893585 0.77 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-8498690406 0.77 COC1=CC(OC)=CC2=C1C(=O)CC(C1=CC=C(OC)C=C1)O2
MCULE-2855478624 0.77 C1(O)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-8068976578 0.77 C12C(OC)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)OC
MCULE-6305563775 0.77 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-7196504979 0.77 C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-8084114235 0.77 [C@H]1(C2=CC=CC=C2)OC2=CC(O)=CC(OC)=C2C(=O)C1
MCULE-7826903505 0.77 C1(O)C=C2OC(C3C=CC=CC=3)CC(C2=C(OC)C=1)=O
MCULE-5052743999 0.77 O=C1C2C(=CC(=CC=2OC(C2C=CC=CC=2)C1)OC)O
MCULE-7258052902 0.77 C1(OC)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-8139621595 0.77 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MolPort-039-052-470 0.77 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(OC)C=C(OC)C=C2O1
MolPort-039-338-389 0.77 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(OC)C=C(O)C=C2O1
MolPort-001-741-519 0.77 COC1=CC(O)=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-003-939-134 0.77 COC1=CC2=C(C(=O)C[C@H](O2)C2=CC=CC=C2)C(O)=C1
MolPort-001-740-709 0.77 COC1=C2C(=O)CC(OC2=CC(O)=C1)C1=CC=CC=C1
MolPort-009-754-963 0.77 COC1=CC(O)=CC2=C1C(=O)C[C@H](O2)C1=CC=CC=C1
MolPort-042-624-490 0.77 COC1=C2C(=O)[C@H](O)[C@H](OC2=C(CC=C(C)C)C(O)=C1)C1=CC=C(O)C=C1
MolPort-006-318-926 0.76 CC1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-000-850-878 0.76 OC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-003-757-733 0.76 CC(C)(C)C1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-042-623-374 0.76 CC(C)(C)C1CCC2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-042-623-389 0.76 CC1CCC2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-003-873-390 0.76 CC1(C)CC(=O)C2=C(O1)C=CC=C2O
MolPort-003-712-357 0.76 COC1=CC2=C(C=C1)C(=O)CCO2
MCULE-7338372949 0.76 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(O)=O
MCULE-7474710506 0.76 C12C=C(C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O)OCC(O)=O
MCULE-7523413286 0.76 C12=CC(=CC=C1C(CC1(CCC(CC1)C)O2)=O)OCC(O)=O
MCULE-1718966435 0.76 CC1(OC2=C(C(=CC=C2)O)C(=O)C1)C
MCULE-4427780251 0.76 C12=C(C)C(OC)=CC(O)=C1C(CC(C1C=CC=CC=1)O2)=O
MCULE-8293297438 0.76 C12C=CC(=CC=1OCCC2=O)OC
MCULE-9865914914 0.76 C1(O)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC(O)=CC=1
MCULE-3240859900 0.76 C1(OC)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-2862082028 0.76 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1
MCULE-6698275589 0.76 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-1297538743 0.76 C1(OC)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-3494790566 0.76 CC1(OC2=C(C=CC(=C2)OCCOC2=CC=C(F)C=C2)C(=O)C1)C
MCULE-5756285409 0.76 OC1C2C(=O)CC3(OC=2C=C(O)C=1)CCC3
MCULE-6655623237 0.76 C12=C(C)C(O)=CC=C1C(C(C(C)(C)O)O2)=O
MCULE-9332914030 0.76 C12C=C(OC)C=CC=1C(CC(C1C=CC=CC=1)O2)=O
MolPort-005-944-711 0.76 COC1=C2C(=O)CC(OC2=CC(O)=C1)C1=CC=C(O)C=C1
MolPort-039-052-519 0.76 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-009-108-510 0.76 CC1(C)CC(=O)C2=CC=C(OCCOC3=CC=C(F)C=C3)C=C2O1
MolPort-000-165-376 0.76 COC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC=C(O)C=C1
MolPort-035-683-158 0.76 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(OC)C=C2O1
MolPort-035-683-182 0.76 COC1=C2C(=O)C[C@H](OC2=CC(O)=C1)C1=CC=C(O)C=C1
MolPort-008-427-992 0.76 CC1=C(O)C=CC2=C1OC(C2=O)C(C)(C)O
MolPort-039-338-418 0.75 COC1=C(C)C(O)=C2C(=O)C[C@H](OC2=C1C)C1=CC=C(O)C=C1
MolPort-002-914-759 0.75 CC1=CC(OCC(O)=O)=CC2=C1C(=O)CC(C)(C)O2
MolPort-035-705-960 0.75 CC(=O)O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=CC=C1
MolPort-001-742-462 0.75 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-019-937-559 0.75 COC1=C(O)C=C2O[C@@H]([C@@H](O)C(=O)C2=C1)C1=CC=CC=C1
MolPort-039-142-054 0.75 COC1=CC(OC)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-002-893-167 0.75 CC(=O)C1COC2=C(C=C(C)C=C2)C1=O
MolPort-028-599-887 0.75 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(O)C=C2O
MCULE-4547911471 0.75 C1(OC)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-7305711707 0.75 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC(=O)O
MCULE-1272280425 0.75 C12C(=O)CC(OC=1C=C(OC)C(C)=C2O)C1C=CC=CC=1
MCULE-5771493344 0.75 C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1
MCULE-7916081306 0.75 C12=CC(=CC=C1OCC(C(=O)C)C2=O)C
MCULE-6964743359 0.75 C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=CC=1)OC)O
MCULE-2575175530 0.75 C1(O)C=C2OCC(C3C(OC)=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-9439004515 0.75 C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)OC)O
MCULE-9370973230 0.75 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-6631561492 0.75 C1C(=O)C2C(=CC(O)=CC=2O)O[C@@H]1C1C=CC=CC=1
MCULE-9302131889 0.75 C1(O)C=C2OC(C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-6826487644 0.75 C1(=O)C2C=CC=CC=2OC(C2C=CC(=CC=2)O)C1OC
MCULE-5001672302 0.75 C1(C)C(O)=C2C(CC(OC2=C(C)C=1O)C1C=CC(O)=CC=1)=O
MCULE-4107309014 0.75 C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-6580599773 0.75 C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-5863118612 0.75 C12=CC(OC)=CC=C1C(CC1(CCCCC1)O2)=O
MolPort-002-509-256 0.75 OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=CC=C2)C(O)=C1
MolPort-004-952-374 0.75 OC1=CC(O)=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-000-165-378 0.75 OC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC=CC=C1
MolPort-039-338-427 0.75 COC1=C(C)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-001-740-535 0.75 CC1=C(O)C(C)=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-338-107 0.75 CC1=C(O)C(C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-052-460 0.74 CC(=O)O[C@@H]1[C@H](OC2=CC(OC(C)=O)=CC(O)=C2C1=O)C1=CC=CC=C1
MolPort-001-741-799 0.74 O[C@H]1[C@@H](OC2=C([C@H]3[C@@H](OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MolPort-005-909-403 0.74 COC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-045-901-612 0.74 COC1=CC2=C(C=C1)C(=O)C(CO2)C1=CC=CC=C1
MolPort-046-693-674 0.74 COC1=CC=C(C=C1)[C@@H]1COC2=C(C=CC(OC)=C2)C1=O
MolPort-039-142-006 0.74 CC(C)=CCC1=C(O)C=C(O)C2=C1O[C@@H]([C@@H](O)C2=O)C1=CC=CC=C1
MolPort-019-936-989 0.74 CC(C)=CCC1=C2O[C@H]([C@H](O)C(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
MolPort-035-701-832 0.74 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=C(OCC(O)=O)C=CC=C4)C3=C2O1
MolPort-000-693-541 0.74 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1)C=C2O
MolPort-002-507-277 0.74 OC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-000-861-091 0.74 OC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-001-796-145 0.74 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MCULE-7062463801 0.74 C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1
MCULE-4287681592 0.74 C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)[C@@H](O)[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O
MCULE-5596378261 0.74 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(OC)=O
MCULE-6753110271 0.74 C12=C(C)C(O)=CC(O)=C1C(C[C@@H](C1C=CC=CC=1)O2)=O
MCULE-2823268443 0.74 C1(=O)C(C2C=CC=CC=2)COC2C=C(OC)C=CC1=2
MCULE-3292535358 0.74 C12C=CC(OC)=CC=1OC[C@@H](C1=CC=C(OC)C=C1)C2=O
MCULE-1539908631 0.74 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-3335674808 0.74 OC1C=CC([C@@H]2OC3C(C(=O)[C@H]2O)=C(O)C=C(O)C=3C/C=C(\C)/C)=CC=1
MCULE-7823125252 0.74 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OCC(O)=O)=O
MCULE-3755625353 0.74 C12(C(O)=O)CC1C(C1=CC=C(OC)C=C1O2)=O
MCULE-6715037033 0.74 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=CC=1)C1C=CC=CC=1
MCULE-5489217450 0.74 C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)O
MCULE-3254872691 0.74 C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MCULE-2527326110 0.74 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-4005429744 0.74 C1C(=O)C2=C(O)C=C(O)C=C2O[C@@H]1C1C=CC(O)=CC=1
MCULE-5852778653 0.74 C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MCULE-7443154930 0.74 C12C=C3C(OCCC3=O)=CC=1OCCC2=O
MCULE-2417211351 0.74 O=C1C2C(=CC=CC=2OCC1)OC
MCULE-8640026575 0.74 C12C=CC(=CC=1OCCC2=O)O
MCULE-7233709477 0.74 C12C(=O)CC(OC=1C(=C(O)C(C)=C2O)C=O)C1=CC=CC=C1
MCULE-8743190189 0.74 C12C(=CC=CC=1OC(CC2=O)C1=CC=CC=C1)OC
MCULE-2337043419 0.74 C12C=C(C=CC=1C(CC(C1=CC=CC=C1)O2)=O)O
MCULE-8726416131 0.74 C1(O)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=CC=1
MCULE-8465550177 0.74 C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@H](O)C(=O)C2=C(OC)C=1
MCULE-3899679930 0.74 C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MCULE-8195585327 0.74 C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-7104867839 0.74 C1(C)C(O)=C2C(CC(OC2=CC=1O)C1C=CC(O)=CC=1)=O
MCULE-8407686947 0.74 C12OC(C)(C)CC(=O)C1=CC=C(OC)C=2O
MCULE-6542351856 0.74 C12C(O)=CC(=CC=1OC1(CC2=O)CCCCC1)O
MolPort-002-911-518 0.74 O=C1CCOC2=CC3=C(C=C12)C(=O)CCO3
MolPort-006-417-667 0.74 OC1=CC=C2C(=O)CCOC2=C1
MolPort-020-001-853 0.74 COC1=CC=CC2=C1C(=O)CCO2
MolPort-001-742-469 0.74 COC1=CC=CC2=C1C(=O)CC(O2)C1=CC=CC=C1
MolPort-039-338-586 0.74 OC1=CC=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-002-903-717 0.74 OC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC=CC=C1
MolPort-039-339-015 0.74 COC1=C2C(=O)[C@H](O)[C@H](OC2=C(C[C@@H](CC=C(C)C)C(C)=C)C(O)=C1)C1=CC=C(O)C=C1O
MolPort-039-339-014 0.74 COC1=C2C(=O)[C@@H](O)[C@H](OC2=C(C[C@@H](CC=C(C)C)C(C)=C)C(O)=C1)C1=CC=C(O)C=C1O
MolPort-001-740-534 0.74 CC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-046-158-489 0.74 CC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-339-073 0.74 CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
MolPort-044-431-402 0.74 OC1=CC2=C(C(=O)CC3(CCCCC3)O2)C(O)=C1
MolPort-009-683-119 0.73 COC1=CC2=C(C=C1)C(=O)CCCO2
MolPort-046-591-306 0.73 CC1=C2OCCC(=O)C2=CC=C1O
MolPort-039-338-588 0.73 CC(C)=CCC1=CC(=CC(CC=C(C)C)=C1O)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-046-158-519 0.73 CCC(=O)O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=CC=C1
MolPort-038-942-141 0.73 OC1=CC=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-023-298-961 0.73 CC(=O)C1=CC=C2OC(C)(C)CC(=O)C2=C1
MolPort-005-944-750 0.73 OC1=CC=C(C=C1)C1CC(=O)C2=CC=C(O)C=C2O1
MolPort-002-511-352 0.73 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2
MCULE-6630170807 0.73 C12=CC=C(C=C1OCCCC2=O)OC
MCULE-9126215246 0.73 O=C1CCOC2=C1C=CC(O)=C2C
MCULE-7997155475 0.73 C1(O)C=C2O[C@H](C3C=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-1657871638 0.73 C1C=C2OC(C)(C)CC(=O)C2=CC=1C(C)=O
MCULE-5306878717 0.73 C12=CC(O)=CC=C1C(=O)C[C@@]([H])(C1C=CC(=CC=1)O)O2
MCULE-2064774552 0.73 OC1C=CC(C2OC3=CC(O)=CC=C3C(=O)C2)=CC=1
MCULE-5637234780 0.73 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1
MCULE-6674323180 0.73 C12=CC(OC)=CC=C1C(=O)CC(C1=CC=C(C=C1)C(O)=O)O2
MCULE-1405836247 0.73 C1(O)C=C2OCC(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-8328465292 0.73 C1=C(O)C=C2C=C3C(=C(C2=C1OC)O)C(=O)CC(O)(C)O3
MCULE-6273466258 0.73 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-6863370760 0.73 C12C=C(O)C=CC=1C(CC1(CCCCC1)O2)=O
MCULE-1897206983 0.73 C12C=C(O)C=CC=1C(CC1(CCCC(C)C1)O2)=O
MCULE-6916263915 0.73 C12C=C(O)C=CC=1C(CC1(CCC(CC1)C)O2)=O
MCULE-4398219856 0.73 C12C=C(O)C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O
MolPort-008-602-942 0.73 COC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC=C(C=C1)C(O)=O
MolPort-039-141-920 0.73 OC1=CC(O)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-001-739-255 0.73 COC1=CC(O)=CC2=CC3=C(C(=O)CC(C)(O)O3)C(O)=C12
MolPort-003-757-722 0.73 CC1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-039-337-122 0.73 CC(C)=CCC1=C(O)C2=C(O[C@@H]([C@@H](O)C2=O)C2=C(O)C=C(O)C=C2)C(CC=C(C)C)=C1O
MolPort-003-757-724 0.73 CC(C)(C)C1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-003-757-723 0.73 CC1CCC[C@@]2(C1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-002-507-615 0.73 OC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-038-550-587 0.73 CC(C)(C)C1CCC2(CC1)CC(=O)C1=CC=C(O)C=C1O2
MolPort-016-588-829 0.73 CC1CCCC2(C1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-010-759-527 0.73 CC1CCC[C@]2(C1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-016-591-308 0.73 CC1CCC2(CC1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-035-706-525 0.72 COC1=CC2=C(C(=O)C[C@H](O2)C2=CC(O)=CC(O)=C2)C(O)=C1
MolPort-039-338-649 0.72 COC1=C2C(=O)[C@@H](O)[C@H](OC2=C(C[C@@H](CCC(C)(C)O)C(C)=C)C(O)=C1)C1=CC=C(O)C=C1O
MolPort-035-683-126 0.72 CC(=O)OC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-035-701-873 0.72 CC(C)OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-991 0.72 COC1=CC(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-507 0.72 COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-496 0.72 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC=CC=C4)C3=C2O1
MolPort-035-699-893 0.72 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-003-846-731 0.72 OC1=CC=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O
MolPort-027-720-889 0.72 CC1=C(O)C(C)=C2OCC(CC3=CC=C4OCOC4=C3)C(=O)C2=C1O
MolPort-020-005-879 0.72 CC1=C(O)C2=C(OC[C@@H](CC3=CC=C4OCOC4=C3)C2=O)C(C)=C1O
MolPort-039-338-717 0.72 CC(C)=CCC(CC1=C2O[C@@H]([C@@H](O)C(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1O)C(C)=C
MCULE-7830277688 0.72 C1(OC)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-5423915532 0.72 C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-8933677756 0.72 C1(O)C(C[C@@H](CCC(O)(C)C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@H](O)C(=O)C2=C(OC)C=1
MCULE-5907594280 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OC)=O
MCULE-9292245335 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC=C(C=C1)OC(C)C)=O
MCULE-1434608117 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)OC)=O
MCULE-2305079825 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1)=O
MCULE-8064214931 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-5855528622 0.72 C1(O)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-3778540596 0.72 C12(C(OC)=O)CC1C(C1=CC=C(OC)C=C1O2)=O
MCULE-8753334659 0.72 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C
MCULE-5082193272 0.72 O1C2=C(C)C(=C(C)C(=C2C(C(C1)CC1=CC=C2C(=C1)OCO2)=O)O)O
MCULE-9150854361 0.72 C12=CC(OC)=CC=C1CC(CO2)C=O
MCULE-1523399872 0.72 C1(O)C(CC(C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-9197350217 0.72 C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)CC(=O)C2=C(O)C=1
MCULE-9196167573 0.72 C12C(CCC(C)(C)O1)=CC(C=O)=C(OC)C=2
MCULE-7103143686 0.72 C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=CC=3)CC(=O)C2=C(O)C=1
MCULE-5552695561 0.72 C12(COC3=C(C=CC=C3)C1=O)CC2C1C=CC=CC=1
MCULE-3140585141 0.72 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)C(OC)=O
MCULE-5717525103 0.72 C12OC(C)(C)CC(=O)C1=CC=C(OCC1C=CC=C3C=CC=CC=13)C=2C
MCULE-2885326245 0.72 O=C1C2=CC3CCOC=3C=C2OCCC1
MCULE-9337445879 0.72 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C2C=CC=CC=12)OC)=O
MCULE-7803942227 0.72 CC1=CC2C(=O)CC(C)(C)OC=2C=C1
MCULE-2097447105 0.72 C1(C(O)=CC2=C(CCC(C)(C)O2)C=1OC)C(=O)CC1=CC=C(OC)C=C1
MCULE-3688085298 0.72 CC1C=C2C(=O)CC3(COC3)OC2=CC=1
MCULE-3718545840 0.72 C12=C(C)C=C(C=C1OC(CC2=O)(C)C)O
MolPort-029-943-067 0.72 OC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=C(O)C=CC=C1O
MolPort-003-803-440 0.72 COC1=C(C=O)C=C2CCC(C)(C)OC2=C1
MolPort-039-052-464 0.72 CC(=O)OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(OC(C)=O)C=C2O1
MolPort-002-855-328 0.72 O=C1C2=CC=CC=C2OCC11CC1C1=CC=CC=C1
MolPort-044-184-424 0.72 OC1=CC=CC2=C1C(=O)CCO2
MolPort-035-700-075 0.72 COC1=CC=C(C2CC(=O)OC3=CC=C4C(=O)CC(C)(C)OC4=C23)C2=CC=CC=C12
MolPort-000-693-537 0.72 COC(=O)C1=CC=C(COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-000-145-683 0.72 CC1=CC(O)=CC2=C1C(=O)CC(C)(C)O2
MolPort-002-819-128 0.72 CC1CC(=O)C2=C(O1)C=CC(C)=C2
MolPort-001-766-894 0.71 CC(C)(C)C1=C(O)C(O)=C2OC(C)(C)CC(=O)C2=C1
MolPort-000-734-672 0.71 CC(=O)OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=CC=C2)C(OC(C)=O)=C1
MolPort-001-740-746 0.71 COC1=CC2=C(C(O)=C1)C(=O)[C@H](OC(C)=O)[C@H](O2)C1=CC(O)=C(O)C=C1
MolPort-035-705-966 0.71 OC1=CC=C([C@@H]2CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)=C1
MolPort-005-945-643 0.71 OC1=CC(O)=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-028-599-906 0.71 COC1=CC2=C(C(=O)C[C@H](O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-000-769-419 0.71 COC1=CC2=C(C(=O)CC(O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-028-771-904 0.71 OCC1(COC2=CC=C3C(=O)CC4(CCCCC4)OC3=C2)COC1
MolPort-039-338-895 0.71 COC1=CC(O)=C2C(=O)[C@H]([C@H](OC2=C1)C1=CC=C(O)C=C1)[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-970 0.71 COC1=CC=C(C=C1)[C@H]1OC2=CC(OC)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-973 0.71 COC1=CC=C(C=C1)[C@H]1OC2=CC(OC)=CC(O)=C2C(=O)[C@@H]1[C@H]1[C@@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(OC)C=C1
MolPort-035-874-008 0.71 CC(C)CC1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-044-807-256 0.71 COC(COC1=CC=C2C(=O)CC3(CCCCC3)OC2=C1)C1CCOC1
MolPort-046-761-030 0.71 COC1=CC=C(C=C1)[C@H]1OC2=CC(OC)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(OC)C=C1
MCULE-4502863447 0.71 O([C@@H]1[C@@H](C2C=CC(O)=C(O)C=2)OC2C(C1=O)=C(O)C=C(OC)C=2)C(C)=O
MCULE-8819587770 0.71 C(OC1=CC2OCCC(=O)C=2C=C1)(=O)C(C)(C)C
MCULE-2611502602 0.71 C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC(=O)C)C=1
MCULE-7167906156 0.71 C12OC(C)(C)CC(=O)C1=CC(C(C)(C)C)=C(O)C=2O
MCULE-4756469832 0.71 C12C(OC(C)=O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC=CC=1)OC(C)=O
MCULE-7259979801 0.71 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1
MCULE-7442958115 0.71 OC1C=CC(C2OC3C(C(=O)C2)=C(O)C=C(O)C=3)=C(O)C=1
MCULE-9912369691 0.71 C1(C(CCCCCCCCC)=O)=CC=C(C=C1OCCCCCCCC)OCCCCCCCC
MCULE-4928479927 0.71 C1(OC)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-2703837005 0.71 C1(OC)C=C2OC(CC(C2=C(O)C=1)=O)C1C=CC(O)=C(O)C=1
MCULE-4806891809 0.71 COC(C1COCC1)COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1
MCULE-2827316384 0.71 C12OC3(CCCCC3)CC(=O)C1=CC=C1OC(=O)CC(CC(C)C)C=21
MCULE-7988809823 0.71 C1(OC)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-7513860584 0.71 C1(OC)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-9617502889 0.71 C1(OC)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-3930952492 0.71 OCC1(COC1)COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1
MCULE-1708111551 0.71 O1CCCC(=O)C2=CC(C)=C(O)C=C12
MCULE-7359426276 0.71 CC1(OC2=C(C=CC=C2)C(=O)C1)C
MCULE-3703285153 0.71 C1(O)C=C2O[C@H](C3C(O)=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-3563693636 0.71 C1OC2=C(C=CC(O)=C2C)C(=O)C1C1=CC=C(O)C=C1
MCULE-8081389858 0.71 C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=CC=3)CC(=O)C2=C(OC(=O)C)C=1
MCULE-7842380240 0.71 C(C1C(O)=C(CC2C(O)=CC=CC=2)C(O)=C2C=1O[C@H](C1C=CC=CC=1)CC2=O)C1=C(O)C=CC=C1
MCULE-1782797624 0.71 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C=O
MCULE-7161357590 0.71 [C@@H]1([C@H](O)C(C2C=CC=CC=2O1)=O)C1=CC=C(Cl)C=C1
MCULE-6609850631 0.71 C12C(=O)CC(OC=1C=C1C(C(O)=CC(O)=C1C1=C(O)C=C(C3=C(C4C(CC(C)OC=4C=C31)=O)O)O)=C2O)C
MCULE-5956278100 0.71 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OC
MCULE-3467826093 0.71 C12OC(CC(=O)C=1C(OC)=CC(OC)=C2OC)(C)C
MCULE-3924606015 0.71 C1(O)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-4827438323 0.71 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1CC1C(O)=CC=CC=1
MCULE-5463631459 0.71 C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MolPort-027-633-019 0.71 O=C1CC2(COC2)OC2=CC=CC=C12
MolPort-000-679-470 0.71 CC1(C)CC(=O)C2=C(O1)C=CC=C2
MolPort-038-948-087 0.71 C[C@@H]1CC(=O)C2=C(O1)C=CC=C2
MolPort-044-754-168 0.71 CC(C)=CCC1=C(O)C(CC=C(C)C)=C(O)C(=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-046-693-050 0.71 OCC(O)COC1=CC=CC=C1C(=O)CCC1=CC=CC=C1
MolPort-039-339-057 0.71 CC1=C2OC[C@@H](CC3=CC4=C(OCO4)C=C3)C(=O)C2=C(O)C(C=O)=C1O
MolPort-002-903-722 0.71 O[C@H]1[C@@H](OC2=C(C=CC=C2)C1=O)C1=CC=C(Cl)C=C1
MolPort-039-052-466 0.71 CC(=O)OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(OC(C)=O)C=C(OC(C)=O)C=C2O1
MolPort-042-675-535 0.71 OC1=CC=CC=C1CC1=C(O)C(CC2=CC=CC=C2O)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-739-590 0.71 CC1CC(=O)C2=C(O)C3=C(O)C=C(O)C(=C3C=C2O1)C1=C2C=C3OC(C)CC(=O)C3=C(O)C2=C(O)C=C1O
MolPort-001-793-312 0.71 COC1=CC2=C(C=C1OC)C(=O)CC(C)(C)O2
MolPort-035-683-148 0.71 OC1=CC(=CC(O)=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-044-754-077 0.71 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(OC)C(O)=C1
MolPort-042-675-534 0.71 OC1=CC=CC=C1CC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-741-458 0.70 OC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(O)C=C(O)C([C@H]3[C@@H](OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)=C2O1
MolPort-046-158-480 0.70 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C([C@@H]3[C@H](OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)=C2O1
MolPort-046-158-448 0.70 CC(=O)C1=C(O)C=C2OC(CC2=C1)C(C)(O)CO
MolPort-002-843-893 0.70 CC1(C)CC(=O)C2=C(O1)C1=CC=CC=C1C=C2
MolPort-000-693-540 0.70 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC(Cl)=C(Cl)C=C1)C=C2O
MolPort-046-158-447 0.70 COC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(OC)C=C1
MolPort-021-804-544 0.70 COC1=CC=C(C=C1)C1OC2=CC(O)=CC(O)=C2C(=O)C1C1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(OC)C=C1
MolPort-005-945-830 0.70 COC1=CC=C(C=C1)C1OC2=CC(O)=CC(O)=C2C(=O)C1C1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MolPort-039-338-971 0.70 COC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@@H]1[C@@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(OC)C=C1
MolPort-039-338-896 0.70 COC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-009-560-828 0.70 COC1=CC=C2CC(COC2=C1)C(O)=O
MolPort-046-690-138 0.70 OC(COC1=CC=CC=C1C(=O)CCC1=CC=CC=C1)COC1=CC=CC=C1C(=O)CCC1=CC=CC=C1
MolPort-002-472-733 0.70 CCCOC1=CC=C2CC(COC2=C1)C(O)=O
MCULE-7028658249 0.70 C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)C[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O
MCULE-2109953476 0.70 C12C3=CC=CC=C3C=CC=1C(CC(C)(C)O2)=O
MCULE-4071615581 0.70 C1(O)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-3613127722 0.70 O(C)C1=CC=C(C2OC3C(C(=O)C2C2C(OC4C(C2=O)=C(O)C=C(O)C=4)C2C=CC(O)=CC=2)=C(O)C=C(C=3)O)C=C1
MCULE-9688299119 0.70 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=C(Cl)C=1)Cl
MCULE-8939875451 0.70 C1(O)C=C2O[C@]([H])(C3C=CC(OC)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-1018595313 0.70 O(C)C1C=CC(C2OC3C(C(=O)C2C2C(OC4C(C2=O)=C(O)C=C(O)C=4)C2C=CC(OC)=CC=2)=C(O)C=C(O)C=3)=CC=1
MCULE-4950757386 0.70 CCCOC1=CC2=C(CC(C(O)=O)CO2)C=C1
MCULE-3631128471 0.70 COC1=CC2=C(CC(C(O)=O)CO2)C=C1
MCULE-2731378392 0.70 O1CCCC(=O)C2=CC=C(O)C(C)=C12
MCULE-9748121668 0.70 O1C(C)C(C2C=CC3=C(C=2)OCCO3)C(C2C=C(CCC)C(OC)=CC1=2)=O
MCULE-6668187578 0.70 C(C1C(O)=CC(O)=C2C=1O[C@H](C1C=CC=CC=1)CC2=O)C1=C(O)C=CC=C1
MCULE-4926347738 0.70 O1C2=CC=CC=C2C(CC1C(O)=O)=O
MCULE-9275834213 0.70 C1(C)(C(O)=O)CC(=O)C2C(=CC=CC=2)O1
MCULE-6647372730 0.70 C(=C(/C)\C)\CC1C(=C2C(OC(C)C(C)C2=O)=C(C(CC(=O)O)CCC)C=1OC)O
MCULE-3965785693 0.70 C1(C2=CC=C(OCC3=CC=CC=C3)C(OCC3=CC=CC=C3)=C2)OC2=C(C=CC=C2)C(=O)C1O
MCULE-4262133747 0.70 C1C=C(C(=O)C2C3OC(C)(C)C4CCC(O)(C)C5OC(C=3C45)=CC=2O)C=CC=1
MCULE-2805260891 0.70 C12(COC3=C(C=CC=C3)C1=O)C(O2)C1=CC=C(C=C1)C(C)C
MCULE-7736830441 0.70 C12OC(CC(=O)C=1C=CC(OCC1=C(C)C=C(C)C=C1C)=C2C)(C)C
MCULE-3558918209 0.70 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)Br
MCULE-2028448851 0.70 C1(O)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-9044534531 0.70 C12C(O)=CC(O)=CC=1OC(CC2=O)C1C=CC(OC)=C(O)C=1
MCULE-7131810532 0.70 C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)O
MCULE-9396529091 0.70 C1(O)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-2236290715 0.70 C12=C(O)C=C(O)C=C1O[C@H](CC2=O)C1=CC=C(OC)C(O)=C1
MCULE-3964122627 0.70 CC1(C(OC)OC)OC2C(=CC=CC=2)C(=O)C1
MCULE-9481971519 0.70 C1(C(CCC)=O)=CC=C(C=C1O)OCCCC
MCULE-1090625056 0.70 O[C@@H]1[C@@H](C2=CC=C(O)C=C2)OC2C(=C(C(C/C=C(\C)/CC/C=C(\C)/C)=C(O)C=2)O)C1=O
MolPort-042-675-533 0.70 OC1=CC=CC=C1CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=CC=C1
MolPort-003-762-751 0.70 CC1(CC(=O)C2=CC=CC=C2O1)C(O)=O
MolPort-003-762-728 0.70 OC(=O)C1CC(=O)C2=C(O1)C=CC=C2
MolPort-021-804-590 0.70 CCCC(CC(O)=O)C1=C(OC)C(CC=C(C)C)=C(O)C2=C1OC(C)C(C)C2=O
MolPort-002-499-601 0.70 CCC1(C)CC(=O)C2=CC=CC=C2O1
MolPort-001-821-106 0.70 CC1=CC(C)=C(COC2=C(C)C3=C(C=C2)C(=O)CC(C)(C)O3)C(C)=C1
MolPort-046-153-065 0.70 CC1(O)CCC2C3C1OC1=CC(O)=C(C(=O)C4=CC=CC=C4)C(OC2(C)C)=C31
MolPort-000-693-538 0.70 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC=C(Br)C=C1)C=C2O
MolPort-046-195-635 0.70 COC(OC)C1(C)CC(=O)C2=CC=CC=C2O1
MolPort-002-893-747 0.70 COC1=C(O)C=C(C=C1)[C@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-003-665-801 0.70 COC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-001-741-418 0.70 COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-046-689-929 0.70 [2H]C([2H])([2H])OC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-046-689-605 0.70 COC1=CC(OC)=C2C(OC3(C(C)CC(=O)CC3=O)C2=O)=C1
MolPort-005-945-312 0.70 CC(C)=CCC\C(C)=C\CC1=C(O)C=C2O[C@@H]([C@@H](O)C(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-001-742-743 0.69 OC1=C(O)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-001-740-726 0.69 OC1=CC2=C(C(=O)CC(O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-003-938-846 0.69 OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=C(O)C(O)=C2)C(O)=C1
MolPort-002-508-671 0.69 OC1=CC2=C(C=C1)C(=O)C(C(C1C(=O)OC3=C(C=CC(O)=C3)C1=O)C1=C(O)C=CC=C1)C(=O)O2
MolPort-039-338-897 0.69 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-001-742-227 0.69 OC1=CC=C(C=C1)C1OC2=CC(O)=CC(O)=C2C(=O)C1C1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MolPort-039-338-901 0.69 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1[C@H]1[C@@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-900 0.69 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-899 0.69 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@H]1[C@@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-039-338-898 0.69 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@H]1[C@@H]1[C@@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-001-513-154 0.69 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC=C2
MolPort-044-586-850 0.69 COC1=CC=C2CCC(CO)OC2=C1
MolPort-002-893-161 0.69 CCCC1=C(O)C=CC2=C1OC(C)(CCC(=O)OC)CC2=O
MolPort-002-536-086 0.69 CC(C)(CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-005-924-596 0.69 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCCO)C=C2O
MolPort-046-158-530 0.69 COC1=C(O)C=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-039-055-793 0.69 C[C@@H](CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MCULE-7325867187 0.69 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OCC
MCULE-6923632463 0.69 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1O
MCULE-1688833251 0.69 C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3225229511 0.69 C1(O)C(O)=CC([C@H]2OC3C=C(O)C=C(O)C=3C(=O)C2)=CC=1
MCULE-8678602121 0.69 C1(O)=CC(O)=C2C(CC(C3C=CC(O)=C(O)C=3)OC2=C1)=O
MCULE-1746821853 0.69 C1(C(CCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-8193782270 0.69 C1(C(CCCCCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-4867351823 0.69 C12=CC=C(C=C1OCCC2=O)OCC1C=CC=CC=1
MCULE-3047713071 0.69 C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-5215717105 0.69 C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-9748713051 0.69 C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-9352490355 0.69 C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@@]([H])([C@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-3436478692 0.69 C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)[C@@]([H])([C@@]3([H])C(=O)C4C(O)=CC(O)=CC=4O[C@]3([H])C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-7927912257 0.69 C1(C=C2OC(C3C=CC(=CC=3)O)C(C3C(C4C=CC(O)=CC=4)OC4C(C3=O)=C(O)C=C(O)C=4)C(C2=C(O)C=1)=O)O
MCULE-3177740984 0.69 C1(C(C2=CC=CC=C2O)C2C(=O)C3C=CC(=CC=3OC2=O)O)C(=O)C2C=CC(=CC=2OC1=O)O
MCULE-6921330240 0.69 C(OC1C=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-5357027007 0.69 C1=C2OC(C3=CC=C(OC)C=C3)CC(=O)C2=CC=C1
MCULE-8760845726 0.69 C12(CC3=CC=C(C=C3)Br)C(=O)C3C=CC=CC=3OC1O2
MCULE-1723755110 0.69 C12OC(CC(=O)C1=CC=C(O)C=2CCC)(C)CCC(=O)OC
MCULE-1834901303 0.69 C12=CC(OCCN3CCOCC3)=CC=C1C(CC(C)(C)O2)=O
MCULE-2643594080 0.69 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@@H](C)CO
MCULE-3308274010 0.69 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCCO)=O
MCULE-2677968878 0.69 C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-7729342140 0.69 C1C=C(C(=O)C2C3OC(C)(C)CCC=3C(O)=CC=2O)C=CC=1
MCULE-4959289073 0.69 O1[C@H](C2=CC=CC=C2)[C@H](O)CC2C=CC(OC)=CC1=2
MCULE-5729797705 0.69 C12OC(CC(=O)C=1C(OC)=CC(O)=C2C/C=C(\C)/C)C1C=CC(O)=CC=1
MCULE-9052045784 0.69 C1(OC)C(C/C=C(\C)/C)=C2C(C(=O)C[C@H](O2)C2C=CC=CC=2)=C(C=1)OC
MCULE-1825001608 0.69 C1(O)C(C/C=C(/C)\C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-1758396763 0.69 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC(C)C
MCULE-5458695470 0.69 C1(C=CC(=CC=1OC)OC)C(=O)CC(OC)=O
MCULE-1371331265 0.69 C1C(=C(C(=O)CCC)C(=C(C=1O)CCO)O)OC
MCULE-3486036343 0.69 C1=CC=C(C(C(=O)CCC2C=CC=CC=2)=C1)OCC1CO1
MCULE-5495431317 0.69 C1(C(C)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-2325690490 0.69 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)OCC(C)=C)=O
MCULE-6209795779 0.69 C12=C(C)C=C(C=C1OC(CC2=O)(C)C)OC(C(OCC)=O)C(OCC)=O
MCULE-7083569963 0.69 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC=C(C=1)N(=O)=O
MolPort-039-338-751 0.69 CC(C)=CC[C@H](CC1=C2O[C@@H]([C@@H](O)C(=O)C2=C(O)C(CC=C(C)C)=C1O)C1=CC=C(O)C=C1O)C(C)=C
MolPort-023-298-963 0.69 CC1(C)CCC2=C(O)C=C(O)C(C(=O)C3=CC=CC=C3)=C2O1
MolPort-002-834-809 0.69 COC1=CC2=C(C[C@@H](O)[C@H](O2)C2=CC=CC=C2)C=C1
MolPort-003-849-812 0.69 COC1=CC(OC)=C2C(=O)CC(OC2=C1)C1=CC(OC)=C(OC)C(OC)=C1
MolPort-039-337-096 0.69 COC1=CC(O)=C(CC=C(C)C)C2=C1C(=O)CC(O2)C1=CC=C(O)C=C1
MolPort-023-275-753 0.69 COC1=CC(OC)=C2C(=O)C[C@H](OC2=C1CC=C(C)C)C1=CC=CC=C1
MolPort-039-339-032 0.69 COC1=C2C(=O)C[C@H](OC2=C(CC=C(C)C)C(O)=C1)C1=CC=C(O)C=C1
MolPort-000-154-681 0.69 COC(=O)CC(=O)C1=CC=C(OC)C=C1OC
MolPort-000-853-573 0.69 CC(C)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-001-739-250 0.69 CCCC(=O)C1=C(OC)C=C(O)C(CCO)=C1O
MolPort-046-158-531 0.69 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(O)C=C1
MolPort-003-847-074 0.69 O=C(CCC1=CC=CC=C1)C1=C(OCC2CO2)C=CC=C1
MolPort-046-202-610 0.69 O=C1C2CC2OC2=C1C=CC=C2
MolPort-035-701-517 0.69 CC(=C)COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-005-945-935 0.69 OC1CC2=C(O)C=C3OC(C4=CC=C(O)C=C4)C4(OC5=C(C4=O)C(O)=CC(O)=C5)C3=C2OC1C1=CC=C(O)C=C1
MolPort-042-665-880 0.68 COC1=C(O)C=CC(=C1)C1OC2=C(OC1CO)C=CC(=C2)[C@H]1OC2=C(C(O)=CC(O)=C2)C(=O)[C@@H]1O
MolPort-039-139-345 0.68 COC1=C(O)C=CC(=C1)[C@@H]1OC2=CC(=CC=C2O[C@H]1CO)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-020-006-004 0.68 COC1=CC(=CC=C1O)C1OC2=C(OC1CO)C=C(C=C2)[C@H]1OC2=C(C(O)=CC(O)=C2)C(=O)[C@@H]1O
MolPort-002-927-301 0.68 COC1=CC=C(CCC(=O)C2=C(OC)C=C(OC)C=C2)C=C1
MolPort-016-633-341 0.68 COC1=CC(=CC=C1O)C1OC2=C(OC1CO)C=C(C=C2)C1OC2=C(C(O)=CC(O)=C2)C(=O)C1O
MolPort-020-364-972 0.68 CC1COC2=CC=CC=C2C1=O
MolPort-001-741-606 0.68 COC1=CC(=CC=C1O)[C@H]1OC2=C(O[C@@H]1CO)C=CC(=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-000-165-369 0.68 COC1=CC(OC)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1
MolPort-046-790-429 0.68 COC1=C(O)C=CC(=C1)[C@H]1OC2=C(O[C@@H]1CO)C=C(C=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-046-790-428 0.68 COC1=C(O)C=CC(=C1)[C@@H]1OC2=C(O[C@H]1CO)C=C(C=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-001-740-173 0.68 OC1=CC=C2C(=O)CC(OC2=C1)C1=CC(O)=C(O)C=C1
MolPort-039-338-317 0.68 OC1=CC=C2C(=O)C[C@H](OC2=C1)C1=CC(O)=C(O)C=C1
MolPort-001-913-435 0.68 COC1=C(O)C=CC(=C1)C1OC2=CC(=CC=C2OC1CO)C1OC2=C(C(O)=CC(O)=C2)C(=O)C1O
MolPort-029-759-368 0.68 CC1(C)COC2=C(C=CC=C2)C1=O
MolPort-009-018-976 0.68 COC1=CC(=CC=C1O)[C@H]1OC2=CC(=CC=C2OC1CO)C1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-044-724-658 0.68 COC1=C(O)C=CC(=C1)C1OC2=C(OC1CO)C=C(C=C2)C1OC2=C(C(O)=CC(O)=C2)C(=O)[C@@H]1O
MolPort-035-705-965 0.68 OC1=CC=C2C(=O)C[C@H](OC2=C1)C1=CC(O)=C(O)C(O)=C1
MolPort-002-534-542 0.68 COC1=C(O)C=CC(=C1)[C@H]1OC2=CC(=CC=C2O[C@@H]1CO)[C@@H]1OC2=C(C(O)=CC(O)=C2)C(=O)[C@H]1O
MolPort-008-646-899 0.68 CC(C)C1=CC=C2OCCC(=O)C2=C1
MolPort-008-645-056 0.68 CCC1=CC2=C(OCCC2=O)C=C1
MolPort-002-915-537 0.68 CC(=O)O[C@H]1[C@@H](OC2=CC=CC=C2C1=O)C1=CC=CC=C1
MolPort-004-960-064 0.68 OC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC=C2
MolPort-002-910-536 0.68 CC1(C)CC(=O)C2=C(O1)C=C(O)C(Cl)=C2
MolPort-005-945-868 0.68 CC(C)=CCOC1=CC=C(C=C1)C1CC(=O)C2=CC=C(O)C=C2O1
MolPort-035-683-180 0.68 OC1=CC=C(C=C1)C1(O)CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-039-338-699 0.68 COC1=C(OC)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-046-158-525 0.68 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(OC)C=C1
MolPort-008-645-059 0.68 CC1=CC2=C(OCCC2=O)C(C)=C1
MolPort-002-846-527 0.68 CC1(C)CCC2=C3OC(C)(C)CCC3=CC=C2O1
MolPort-035-701-388 0.68 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC=C(C=C4)C(O)=O)C3=C2O1
MolPort-004-289-999 0.68 OC(=O)C1COC2=CC(O)=CC=C2C1
MCULE-8379030042 0.68 C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O
MCULE-1069224262 0.68 O=C1C2C(=CC=C(C=2)C(C)(C)C)OCC1
MCULE-2276070011 0.68 C1OC2=C(C=C(CC)C=C2)C(=O)C1
MCULE-9679610001 0.68 CC(C1=CC2=C(OCCC2=O)C=C1)C
MCULE-8148398497 0.68 [C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OC(=O)C)C1C=CC=CC=1
MCULE-9553245353 0.68 C1C=C2CCC(OC2=CC=1OC(C)(C)C(=O)OC)CO
MCULE-6331583005 0.68 O1C(C2C=CC(=CC=2)O)CC(C2C=CC=CC=21)=O
MCULE-9221415167 0.68 C1(C)(C)CC(C2=CC(=C(O)C=C2O1)Cl)=O
MCULE-7064559962 0.68 C1(O)C=C2OC(O)(C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-2232530891 0.68 C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-1692843751 0.68 C12CCC(OC=1C=CC1CCC(C)(C)OC2=1)(C)C
MCULE-7249832807 0.68 CC1=CC2=C(OCCC2=O)C(C)=C1
MCULE-6097982009 0.68 C(C1=CC=C(O)C=C1O)(=O)CCC1=CC=C(OC)C(C)=C1OC
MCULE-8848992989 0.68 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(O)=O)=O
MCULE-5783041391 0.68 OC(C1CC2=C(C=C(C=C2)O)OC1)=O
MCULE-4060250781 0.68 C12O[C@@H](C(C)C)CC1=C1O[C@]3([H])COC4C(=CC(OC)=C(OC)C=4)[C@]3([H])C(=O)C1=CC=2
MCULE-2808039967 0.68 O1C2=CC(OC)=C(OC)C=C2C2(C(C3C(=C4CC(C(C)C)OC4=CC=3)OC2(C1)[H])=O)[H]
MCULE-1097395119 0.68 C1C=C2C(OC(CC2=O)C2C=CC(C3C=CC=CC=3)=CC=2)=CC=1O
MCULE-5742809714 0.68 C1(OC)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1O
MCULE-8095520519 0.68 C1(C=CC(=CC=1OC)OC)C(=O)CCC1C=CC=CC=1O
MCULE-8498305648 0.68 C1(C=CC(=CC=1OC)OC)C(=O)CCC1=CC=C(C=C1OC)OC
MCULE-1886187207 0.68 C1(C(C)=O)C(=CC=C(CCC)C=1O)OCC(C)O
MCULE-4810068413 0.68 C1(O)C(C/C=C(\C)/C)=C2OC(C3C=CC4OC(C)(C)C(O)C(O)C=4C=3)CC(=O)C2=CC=1
MCULE-5696384668 0.68 O=C1C2=C(C=CC=C2)OC2(CCC2)C1
MCULE-1916199374 0.68 C12OC3COC4=C(C=C(C(OC)=C4)OC)C3C(=O)C=1C=CC1=C2CC(O1)C(C)=O
MCULE-4773129937 0.68 C1(OC(C)=O)=CC(=CC=C1C(CCC1C=CC=CC=1)=O)OC(C)=O
MCULE-1427011280 0.68 C1C=C(C(=O)C2C(O)=C3CCC(C)(C)OC3=CC=2O)C=CC=1
MCULE-2776613173 0.68 C12C=CC(C)=CC=1C(=O)CC(C1C=CC=CC=1)O2
MCULE-4861196207 0.68 [C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@H]1C
MCULE-6303182626 0.68 C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(F)=CC=1
MCULE-6772374144 0.68 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC=CC=1
MCULE-8926090259 0.68 C1(OC)C(O)=C2O[C@H](CC(C2=C(O)C=1)=O)C1C(O)=CC=CC=1
MCULE-8371282223 0.68 C1(=CC=C(C=C1OC)OC)C(CCC1=CC=CC=C1)=O
MCULE-1171828876 0.68 C1(C(=O)CCC2C=CC(OC)=CC=2)=C(O)C=C(OC)C=C1OC
MCULE-7478537845 0.68 C1(C(=O)CCC2C=CC(OC)=CC=2)=CC=C(OC)C=C1OC
MCULE-6906830879 0.68 C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-9899038190 0.68 OC1C=C2OC(C3C=CC(O)=C(O)C=3)CC(C2=CC=1)=O
MCULE-1131774635 0.68 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-9092075985 0.68 C1(O)C=C2O[C@H](C3C=CC4O[C@H](C5C=CC(OC)=C(O)C=5)[C@@H](CO)OC=4C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6463439345 0.68 C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O
MCULE-4152291525 0.68 C12C(O)=CC(=CC=1O[C@@]([C@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1C=CC(=C(OC)C=1)O)O
MCULE-9566565950 0.68 O=C1C2C(=CC(=CC=2O[C@H](C2C=C3C(O[C@H]([C@H](O3)C3C=C(OC)C(O)=CC=3)CO)=CC=2)[C@H]1O)O)O
MCULE-6390383057 0.68 COC1C=C(C2C(CO)OC3C=C(C4C(O)C(=O)C5C(=CC(=CC=5O)O)O4)C=CC=3O2)C=CC=1O
MCULE-7201821938 0.68 C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC2=C(C=1)OC(C(CO)O2)C1=CC=C(C(OC)=C1)O)O
MCULE-6637888420 0.68 O1C2C=C(C=CC=2O[C@@H](CO)[C@@H]1C1=CC=C(C(=C1)OC)O)[C@H]1[C@H](C(C2=C(C=C(C=C2O1)O)O)=O)O
MolPort-002-893-977 0.68 COC1=C(OC)C=C2[C@H]3[C@@H](COC2=C1)OC1=C(C=CC2=C1C[C@@H](O2)C(C)C)C3=O
MolPort-046-687-425 0.68 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=CC(O)=C(O)C=C2O1
MolPort-023-310-213 0.68 OC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC=C(C=C1)C1=CC=CC=C1
MolPort-039-338-316 0.68 COC1=C(O)C(OC)=C2C(=O)C[C@H](OC2=C1OC)C1=CC=CC=C1
MolPort-001-761-983 0.68 CCCC1=CC=C(OCC(C)O)C(C(C)=O)=C1O
MolPort-002-509-149 0.68 COC1=CC(OC)=C(CCC(=O)C2=C(OC)C=C(OC)C=C2)C=C1
MolPort-002-834-807 0.68 COC1=CC(OC)=C(C=C1)C(=O)CCC1=C(O)C=CC=C1
MolPort-026-950-276 0.68 CC(=O)C1COC2=CC=CC=C2C1
MolPort-042-675-385 0.68 CC(C)=CCC1=C2OC(CC(=O)C2=CC=C1O)C1=CC2=C(OC(C)(C)C(O)C2O)C=C1
MolPort-023-187-072 0.68 O=C1CC2(CCC2)OC2=CC=CC=C12
MolPort-035-800-591 0.68 COC1=C(OC)C=C2C3C(COC2=C1)OC1=C(C=CC2=C1CC(O2)C(C)=O)C3=O
MolPort-023-298-962 0.68 CC1(C)CCC2=C(O)C(C(=O)C3=CC=CC=C3)=C(O)C=C2O1
MolPort-003-848-018 0.68 Cl.CCCNCC(O)COC1=C(C=CC(O)=C1)C(=O)CCC1=CC=CC=C1
MolPort-002-915-227 0.68 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC=C(F)C=C1)C=C2
MolPort-002-915-229 0.68 CC1=CC(OCC2=CC=CC=C2)=CC2=C1C(=O)CC(C)(C)O2
MolPort-001-742-179 0.68 COC1=CC(O)=C2C(=O)C[C@@H](OC2=C1O)C1=CC=CC=C1O
MolPort-006-069-276 0.67 COC1=C(O)C=CC(=C1)[C@@H]1OC2=C(C=C(C=C2O)[C@H]2OC3=C(C(O)=CC(O)=C3)C(=O)[C@@H]2O)[C@H]1CO
MolPort-046-793-183 0.67 COC1=C(O)C=CC(=C1)C1OC2=C(C=C(C=C2O)C2OC3=CC(O)=CC(O)=C3C(=O)C2O)C1CO
MolPort-046-790-479 0.67 COC1=CC(=CC=C1O)[C@H]1OC2=C(C=C(C=C2O)[C@H]2OC3=CC(O)=CC(O)=C3C(=O)[C@@H]2O)[C@@H]1CO
MolPort-002-345-103 0.67 OCC1(CO)COC2=C(C=CC=C2)C1=O
MolPort-003-761-510 0.67 CCC1=CC=C(OCCC(=O)C2=C(O)C=C(O)C=C2)C=C1
MolPort-046-202-547 0.67 O=C1[C@@H]2CC[C@@H]2OC2=C1C=CC=C2
MolPort-003-665-792 0.67 O[C@@H]1CC2=C(O[C@@H]1C1=CC=C(O)C=C1)C=C(O)C=C2O
MolPort-001-740-963 0.67 O[C@H]1CC2=C(O)C=C(O)C=C2O[C@H]1C1=CC=C(O)C=C1
MolPort-019-937-484 0.67 O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C=C1
MolPort-006-319-012 0.67 COC1=C(CN(C)C)C(O)=C2C(=O)CC(C)(C)OC2=C1
MolPort-039-339-001 0.67 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-003-804-010 0.67 COC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC(OC)=C(OC)C(OC)=C1
MolPort-038-387-877 0.67 COC1=CC=C2C(=O)CC(OC2=C1)C1=CC=C(OC)C(OC)=C1
MolPort-000-891-044 0.67 COC1=CC(OC)=C(C=C1)C(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-001-793-702 0.67 CC1=CC2=C(OCCC2=O)C=C1
MCULE-9385881266 0.67 C1(O)C=C2O[C@H](C3C=C(O)C4O[C@@H](C5C=C(OC)C(O)=CC=5)[C@H](CO)C=4C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-1001006382 0.67 C1(=CC=C(C=C1O)O)C(CCOC1C=CC(=CC=1)CC)=O
MCULE-6345475038 0.67 C1(=O)C2C=CC=CC=2OCC1(CO)CO
MCULE-9862512162 0.67 [C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=CC(O)=C2C[C@H]1O
MCULE-3987657618 0.67 C1(O)C=C2O[C@@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1
MCULE-4054125595 0.67 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](O)CC2=C(O)C=1
MCULE-9581242889 0.67 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1
MCULE-4397917979 0.67 C(OC1C(C)=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-6734766646 0.67 C(OC1C=C2C(=CC=1C)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-7135363751 0.67 C12C(=O)CC(OC1=CC(=C(CN(C)C)C=2O)OC)(C)C
MCULE-9660563348 0.67 C12C=CC(OC)=CC=1OC(CC2=O)C1C=CC(OC)=C(OC)C=1
MCULE-8978551782 0.67 COC1=CC(C2OC3C=C(OC)C=CC=3C(=O)C2)=CC(OC)=C1OC
MCULE-8766238232 0.67 C12=C(OC)C=C(C=C1OC1(CC2=O)CCNCC1)OC
MCULE-7018809823 0.67 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-3983609593 0.67 C1(=CC=C(C=C1OC)OC)C(=O)CC(=O)C1C=CC(=CC=1OC)OC
MCULE-3241722945 0.67 C1C=C2C(C(=O)CCO2)=CC=1C
MCULE-7320172868 0.67 C12C(=CC=CC=1OCC(C(O)=O)C2)OC
MCULE-8876698541 0.67 C1C=C2C(=CC=1)C(=O)C[C@@H](C1C=CC=CC=1)O2
MCULE-3925941144 0.67 O1C(C2C=CC=CC=2)CC(C2C=CC=CC=21)=O
MCULE-4267260797 0.67 C12=CC(OC)=CC=C1CC(CO2)CC1=CC=C(C=C1)C(N)=O
MCULE-8135607815 0.67 CC1(OC2=C(C=CC(=C2)OCC2=CC=C(C(N)=O)C=C2)C(=O)C1)C
MCULE-9611172969 0.67 C12(C(O)=O)OC3=CC=C(C=C3C(=O)C1C2)CC
MCULE-9660679251 0.67 C1(O)C=C2OC(CC(C2=C(O)C=1OC)=O)C1C=CC=CC=1
MCULE-9587381415 0.67 C1(O)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3324355674 0.67 C1(C=C2OC(CC(C2=C(O)C=1)=O)C1=CC=C(O)C(OC)=C1)O
MCULE-3601358321 0.67 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-8750784705 0.67 C12C(=O)C[C@H](OC=1C=C(C(C/C=C(/C)\C)=C2O)O)C1C=CC=CC=1
MCULE-9602960797 0.67 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-8847685016 0.67 COC1C=C(O)C(OC)=C2C=1C(CC(C1C=CC=CC=1)O2)=O
MCULE-1448234011 0.67 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-6744641772 0.67 C12C=CC(=C(C)C=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-4193314774 0.67 OC1=C2C(C[C@@H](C3C=CC=CC=3)OC2=C(OC)C(OC)=C1)=O
MCULE-1883133712 0.67 C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1C=CC=CC=1
MCULE-7506688119 0.67 C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1=CC=C(C=C1)OC
MCULE-3643867192 0.67 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=CC=1)OC)=O
MCULE-7172712096 0.67 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=CC=1)O)=O
MCULE-3804005859 0.67 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC=CC=1OC)=O
MCULE-8980836702 0.67 C12OC3(CCCCC3)CC(=O)C=1C=CC(O)=C2O
MCULE-9773979294 0.67 C1(O)(CC(=O)C2C(=CC(=CC=2)OC)O1)C(F)(F)F
MCULE-2735471310 0.67 Cl.C12=C(OC)C=C(C=C1OC1(CC2=O)CCNCC1)OC
MCULE-7008971924 0.67 C1(=O)C(C=O)C(C)(C)OC2=CC=C(OC)C=C12
MCULE-8635359097 0.67 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1O
MCULE-1326957022 0.67 C1(O)(C(F)F)CC(=O)C2C(=CC(=CC=2)OC)O1
MCULE-3736665836 0.67 C12(C(O)=O)OC3=CC=C(C=C3C(=O)C1C2)C
MCULE-3756727785 0.67 C1(C=CC2=C(CCCO2)C=1)C(C(C)O)=O
MCULE-3084067707 0.67 C1(CC2=C3C=CC=CC3=CC=C2OC1=O)C(C1C=CC=CC=1)=O
MCULE-2510689712 0.67 C12OC3(CCC(CC3)C)CC(=O)C=1C=CC(O)=C2O
MCULE-5234886160 0.67 C12C=C(CC)C(=CC=1OCC(C1=CC=CC3OCCOC1=3)C2=O)OC(C)C
MCULE-3149822701 0.67 C1(OC(=O)C)C=C2O[C@H](C3C(OC(=O)C)=CC=CC=3OC(=O)C)CC(=O)C2=C(OC(=O)C)C=1
MCULE-6412237474 0.67 O1C(CC2=CC=C(OC)C=C12)C(O)=O
MCULE-6243783933 0.67 CCCC1=C2C(C(CCO2)=O)=CC=C1
MolPort-022-383-382 0.67 COC1=CC=CC2=C1CC(CO2)C(O)=O
MolPort-027-867-828 0.67 COC1=CC2=C(CC(CC3=CC=C(C=C3)C(N)=O)CO2)C=C1
MolPort-000-696-915 0.67 O=C1CC(OC2=C1C=CC=C2)C1=CC=CC=C1
MolPort-002-511-009 0.67 CC(C)=CCC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-740-728 0.67 COC1=C(O)C=CC(=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-001-742-622 0.67 COC1=CC=C(C=C1)C1CC(=O)C2=C(O)C(CC=C(C)C)=C(O)C=C2O1
MolPort-001-742-504 0.67 CC(C)=CCC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-338-620 0.67 COC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-035-873-741 0.67 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-001-740-631 0.67 COC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-046-153-732 0.67 COC1=CC(=CC=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-035-873-875 0.67 OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-039-052-403 0.67 COC1=C2C(=O)C[C@H](OC2=C(OC)C(O)=C1)C1=CC=CC=C1
MolPort-035-683-131 0.67 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1OC)C1=CC=CC=C1
MolPort-035-873-207 0.67 COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-005-944-620 0.67 COC1=CC(O)=C2C(=O)CC(OC2=C1OC)C1=CC=CC=C1
MolPort-027-700-530 0.67 CC1(C)CC(=O)C2=CC=C(OCC3=CC=C(C=C3)C(N)=O)C=C2O1
MolPort-002-507-617 0.67 CC1CCC2(CC1)CC(=O)C1=C(O2)C(O)=C(O)C=C1
MolPort-002-153-193 0.67 COC1=CC=C2C(=O)CC(O)(OC2=C1)C(F)F
MolPort-046-153-729 0.67 OC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=CC(O)=C(O)C=C2O1
MolPort-003-762-423 0.67 O=C(C1CC2=C(OC1=O)C=CC1=CC=CC=C21)C1=CC=CC=C1
MolPort-000-857-226 0.67 OC1=C(O)C2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-000-746-163 0.67 COC1=CC=C2C(=O)CC(O)(OC2=C1)C(F)(F)F
MolPort-039-052-473 0.67 CC(=O)OC1=CC(OC(C)=O)=C2C(=O)C[C@H](OC2=C1)C1=C(OC(C)=O)C=CC=C1OC(C)=O
MolPort-007-981-120 0.67 COC1=CC2=C(OC(C)(C)C(C=O)C2=O)C=C1
MolPort-008-468-723 0.67 Cl.COC1=CC2=C(C(=O)CC3(CCNCC3)O2)C(OC)=C1
MolPort-000-760-008 0.66 CC(C)=CCC1=C(O)C=C(O)C2=C1OC(CC2=O)C1=CC=CC=C1
MolPort-046-158-486 0.66 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1C1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC(O)=C(O)C=C1
MolPort-039-339-003 0.66 CC(C)=CCC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
MolPort-035-700-616 0.66 COC1=C(OC)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-004-955-124 0.66 CC(C)=CCC1=C(O)C=C(O)C2=C1OC(CC2=O)C1=CC=C(O)C=C1
MolPort-001-742-772 0.66 O[C@@H]1CC2=C(O[C@H]1C1=CC(O)=C(O)C=C1)C=C(OC(=O)C1=CC(O)=C(O)C(O)=C1)C=C2O
MolPort-035-700-418 0.66 COC(=O)C1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-000-657-221 0.66 CCCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-035-701-225 0.66 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-005-944-956 0.66 COC1=C(CC=C(C)C)C=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-002-510-365 0.66 CC(C)=CCC1=C(O)C=C(O)C2=C1O[C@@H](CC2=O)C1=CC=CC=C1
MolPort-002-509-337 0.66 CCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-005-944-746 0.66 OC[C@H]1OC([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C=C2O[C@@H]([C@@H](O)C(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-002-833-163 0.66 CC1(C)CC(=O)C2=C(O1)C=C(CC1=CC=CC=C1)C=C2O
MolPort-005-945-286 0.66 COC1=C(O)C=C2O[C@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-006-417-708 0.66 O=C1CC2(CCCC2)OC2=CC=CC=C12
MolPort-013-264-379 0.66 CC(C)C1=CC=C2OCCCC(=O)C2=C1
MolPort-002-915-225 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=C(F)C=CC=C1)C=C2
MolPort-001-017-668 0.66 O=C1CC2(CCCCCCCCCCC2)OC2=C1C=CC=C2
MolPort-039-052-506 0.66 COC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-002-915-226 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC(F)=CC=C1)C=C2
MolPort-003-803-650 0.66 COC1=C(C=CC(O)=C1)C(=O)CCC1=CC=C(O)C=C1
MolPort-044-754-120 0.66 OC1=CC=C(CC2COC3=CC(O)=CC=C3C2)C=C1
MolPort-001-762-318 0.66 O=C1CCOC2=CC=CC=C12
MolPort-035-705-963 0.66 CC(C)=CCC1=C(O)C=C2O[C@@H](CC(=O)C2=C1)C1=CC=C(O)C=C1
MolPort-002-903-723 0.66 CCCC(=O)O[C@H]1[C@@H](OC2=CC=CC=C2C1=O)C1=CC=CC=C1
MolPort-039-339-013 0.66 COC1=C2C(=O)C[C@H](OC2=C(C[C@@H](CC=C(C)C)C(C)=C)C(O)=C1)C1=C(O)C=C(O)C=C1
MolPort-002-677-505 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCOCC1)C=C2O
MolPort-039-057-296 0.66 CC(C)[C@@H](CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-044-754-063 0.66 OC1=CC=C2C(=O)C[C@H](OC2=C1O)C1=CC(O)=C(O)C=C1
MolPort-046-508-982 0.66 COC1=C(O)C=CC(C2COC3=CC(O)=CC(O)=C3C2=O)=C1OC
MolPort-000-154-677 0.66 CCOC(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-007-926-743 0.66 CC1(C)CC(=O)C2=C(O1)C=CC(O)=C2
MolPort-046-626-488 0.66 CCOC(=O)COC1=CC2=C(CCC(C)(C)O2)C(O)=C1
MCULE-7590247408 0.66 O[C@@H]1[C@@H](O)[C@H](O)[C@H](OC1C1C(O)=C2C(=O)[C@H](O)[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)CO
MCULE-9181884957 0.66 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(OC)=O)=O
MCULE-7295377199 0.66 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC)=O
MCULE-3906381675 0.66 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O
MCULE-9919244870 0.66 C1(C2OC3C(C/C=C(\C)/C)=C(O)C=C(O)C=3C(C2)=O)=CC=C(O)C=C1
MCULE-1693566586 0.66 C12C(C/C=C(/C)\C)=C(O)C=C(O)C=1C(C[C@@H](C1=CC=CC=C1)O2)=O
MCULE-9948220621 0.66 C12C=C(CCC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-3864605326 0.66 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-9858151978 0.66 C12C(C/C=C(/C)\C)=C(O)C=C(O)C=1C(CC(C1=CC=CC=C1)O2)=O
MCULE-8022818849 0.66 C1(=CC(=C2C(O[C@@H](C3=CC=C(C(O)=C3)O)[C@H](O)C2)=C1)O)OC(=O)C1=CC(O)=C(O)C(O)=C1
MCULE-1890542536 0.66 C1(O)C2C(CC(C3C=C(O)C(OC)=CC=3)OC=2C=C(OC)C=1OC)=O
MCULE-3002934523 0.66 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-1880910154 0.66 [C@H]1(C2=CC=C(O)C=C2)OC2=CC(OC)=C(C/C=C(\C)/C)C=C2C(=O)C1
MCULE-4719487645 0.66 C12C=C(CC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-3842882003 0.66 OC1C=CC([C@H]2OC3C(C(=O)C2)=CC(C/C=C(\C)/C)=C(OC)C=3)=CC=1
MCULE-4193299594 0.66 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-3016034856 0.66 C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC1C=CC=CC=1Cl
MCULE-9361233668 0.66 C12OC(CC(=O)C=1C=CC(OCC1=CC=CC(F)=C1)=C2)(C)C
MCULE-1477744891 0.66 C12C=CC(OCC3C=CC=CC=3F)=CC=1OC(CC2=O)(C)C
MCULE-7357907675 0.66 C1(COC2C(=CC=CC=2)C1=O)C(=O)C(OC)=O
MCULE-7760204952 0.66 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)CC1C=CC=CC=1
MCULE-5075432556 0.66 O=C1C2=C(C=CC=C2)OC2(CCCC2)C1
MCULE-1675694697 0.66 CC(C1=CC2=C(OCCCC2=O)C=C1)C
MCULE-5435602548 0.66 C1(C(CCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCC
MCULE-8367548119 0.66 C1(=O)CC2(CCCCCCCCCCC2)OC2C=CC=CC1=2
MCULE-6543223040 0.66 C12C=CC=CC=1OCCC2=O
MCULE-5039398124 0.66 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)CC2=CC=1
MCULE-9773382618 0.66 C1(=CC=C(C=C1OC)O)C(CCC1=CC=C(O)C=C1)=O
MCULE-6856311194 0.66 C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(OC)C=1
MCULE-1804962504 0.66 [C@H]1(OC2=C(C=CC=C2)C(=O)[C@H]1OC(=O)CCC)C1=CC=CC=C1
MCULE-4652067575 0.66 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1C/C=C(\C)/C
MCULE-6039011943 0.66 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@H](CO)C(C)C
MCULE-5659982548 0.66 [C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=C(C/C=C(\C)/C)C=C2C(=O)C1
MCULE-9575020223 0.66 C1(O)C(O)=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-6373579877 0.66 C1(O)C=C2OCC(C3C=CC(O)=C(OC)C=3OC)C(=O)C2=C(O)C=1
MCULE-9493821223 0.66 C12(C(O)=O)OC3=CC=CC=C3C(=O)C1C2
MCULE-1896760231 0.66 C12=CC(OCC(OCC)=O)=CC(O)=C1CCC(C)(C)O2
MCULE-1688334671 0.66 CCOC(CC(C1C=CC(OC)=CC=1OC)=O)=O
MCULE-3818653032 0.66 C12=CC(O)=CC=C1OC(CC2=O)(C)C
MCULE-6501771066 0.66 C1(C(CCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-5610620315 0.66 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-1689119297 0.66 C1(C(CCC)=O)=CC=C(C=C1O)OCCCCCCC
MCULE-3384286474 0.66 C1(C(CCCCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-1369586422 0.66 C1=C(OC)C=CC(C(=O)CC(=O)C)=C1OC
MCULE-6056489539 0.66 C12C(CCC(C)(C)O1)=CC1=C(OC(CC1)(C)C)C=2C
MCULE-3239542040 0.66 C12=CC=CC(C)=C1OCCC2=O
MCULE-6491727713 0.66 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@H](CO)C1C=CC=CC=1
MCULE-2650174810 0.66 O(C)C1=C(C=C([C@H]2OC3C(C(=O)C2)=C(C=C(C=3)O)O)C=C1C/C=C(\C)/C)C/C=C(\C)/C
MCULE-6612299602 0.66 C1(O)C=C2O[C@H](C3C=CC(OC)=C(C/C=C(\C)/C)C=3)CC(=O)C2=C(O)C=1
MCULE-2331262877 0.66 C1(COC2=C(C=CC(OC)=C2)C1=O)C1C(OC)=CC(=C(OC)C=1OC)OC
MCULE-3585893701 0.66 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCC#N)=O
MCULE-4382615498 0.66 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC(C)CC
MCULE-7783767364 0.66 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(NCCC)=O
MCULE-9999599817 0.66 BrC1=CC2=C(C(CC3(O2)COC3)=O)C=C1
MCULE-2636582716 0.66 ClCCCOC1=CC=C2C(OC(O)CC2=O)=C1
MCULE-2120677871 0.66 C12=CC(=CC=C1OC(CC2=O)(C)C)C(O)=O
MCULE-1517499241 0.66 O1[C@H](C2C=CC(=CC=2)C)CC(C2C=CC=CC=21)=O
MCULE-2493375155 0.66 O1C(C2CCCCC2)CC(C2C=CC=CC=21)=O
MCULE-1430452475 0.66 O=C1C2C=CC=CC=2OC2(CCCCC2)C1
MCULE-1774195498 0.66 O1C(C)(C)CCC2=CC(C(C)=O)=CC=C12
MCULE-6108739269 0.66 CC(C1=C2C(C(CCO2)=O)=CC=C1)C
MCULE-6924983703 0.66 C12C(=O)C[C@H](OC=1C(=C(OC)C(C/C=C(\C)/C)=C2OC)C/C=C(\C)/C)C1C(OC)=CC(=CC=1OC)OC
MCULE-8124496200 0.66 C1(O)C=CC(C(=O)CCC2C=CC(OC)=CC=2OC)=CC=1
MCULE-4595357464 0.66 C12=C(C=CC3C=CC=CC1=3)OCCC2=O
MCULE-2544456104 0.66 C1(C(CC)=O)=CC=C(C=C1OCC)OCC
MCULE-6374209365 0.66 C12CCCOC=1C=CC(CCC(C)=O)=C2
MCULE-9068708096 0.66 C1(O)C=CC(C(CCC2C(OC)=CC(OC)=CC=2OC)=O)=CC=1
MCULE-9485581712 0.66 C1(O)C=C2C(C(CC(C3C=CC(O)=C(C/C=C(\C)/C)C=3)O2)=O)=C(O)C=1
MCULE-3021933663 0.66 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1
MCULE-7588457893 0.66 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)N(=O)=O
MCULE-4375575651 0.66 C12=CC(OC)=CC=C1C(CC1(CCNCC1)O2)=O
MCULE-1088177999 0.66 C12OC(CC(=O)C=1C=CC(OCC1C=CC=CC=1F)=C2C)(C)C
MCULE-2751669170 0.66 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC=CC=1OCC(O)=O)=O
MolPort-002-131-116 0.66 CCCCCCCOC1=CC(O)=C(C=C1)C(=O)CCC
MolPort-003-658-887 0.66 COC1=CC(OC)=C(C=C1)C(=O)CC(C)=O
MolPort-002-846-540 0.66 CC1=C2OC(C)(C)CCC2=CC2=C1OC(C)(C)CC2
MolPort-008-644-206 0.66 CC1=CC=CC2=C1OCCC2=O
MolPort-039-057-102 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N[C@H](CO)C1=CC=CC=C1)C=C2O
MolPort-000-847-591 0.66 CCC(C)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-000-847-603 0.66 CCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-005-919-521 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC#N)C=C2O
MolPort-039-337-155 0.66 COC1=C(CC=C(C)C)C=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-005-945-465 0.66 COC1=C(CC=C(C)C)C=C(C=C1CC=C(C)C)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-002-534-970 0.66 CC(C)CNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-044-182-310 0.66 BrC1=CC2=C(C=C1)C(=O)CC1(COC1)O2
MolPort-002-800-144 0.66 CC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=CC=C2
MolPort-008-442-022 0.66 CC1(C)CC(=O)C2=C(O1)C=CC(=C2)C(O)=O
MolPort-046-591-140 0.66 OC1CC(=O)C2=C(O1)C=C(OCCCCl)C=C2
MolPort-006-417-709 0.66 O=C1CC2(CCCCC2)OC2=CC=CC=C12
MolPort-002-819-134 0.66 O=C1CC(OC2=C1C=CC=C2)C1CCCCC1
MolPort-008-646-900 0.66 CC(C)C1=CC=CC2=C1OCCC2=O
MolPort-008-645-057 0.66 CCC1=CC=CC2=C1OCCC2=O
MolPort-002-818-057 0.66 CC(=O)C1=CC2=C(OC(C)(C)CC2)C=C1
MolPort-020-005-759 0.66 COC1=CC=C(CCC(=O)C2=CC=C(O)C=C2)C(OC)=C1
MolPort-005-957-922 0.66 CCOC1=CC(OCC)=C(C=C1)C(=O)CC
MolPort-020-005-754 0.66 COC1=CC(OC)=C(CCC(=O)C2=CC=C(O)C=C2)C(OC)=C1
MolPort-000-875-091 0.66 O=C1CCOC2=C1C1=CC=CC=C1C=C2
MolPort-006-668-563 0.66 CC(C)=CCC1=C2O[C@@H](CC(=O)C2=CC=C1O)C1=CC=C(O)C=C1
MolPort-035-701-957 0.66 CC(=O)C1=CC=C2OC(=O)CC(C3=C(OCC(O)=O)C=CC=C3)C2=C1O
MolPort-001-842-614 0.66 CC1=C(OCC2=C(F)C=CC=C2)C=CC2=C1OC(C)(C)CC2=O
MolPort-003-762-865 0.66 COC1=CC2=C(C=C1)C(=O)CC1(CCNCC1)O2
MolPort-006-668-332 0.66 CC(C)=CCC1=C(O)C=CC(=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-001-740-177 0.66 CC(C)=CCC1=CC(=CC(CC=C(C)C)=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-022-417-411 0.65 CC1(C)CC(=O)C2=C(O1)C=C(Br)C=C2
MolPort-034-339-626 0.65 CCOC(=O)C1COC2=CC=CC=C2C1=O
MolPort-002-893-691 0.65 O=C1C(COC2=C1C=CC=C2)C1=CC=CC=C1
MolPort-035-699-864 0.65 COC1=C(OC(C)C)C=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-701-515 0.65 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-029-887-060 0.65 OC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)CO2
MolPort-038-386-628 0.65 CCCC1CC(=O)OC2=C(CC=C(C)C)C(O)=C3C(=O)C(C)C(C)OC3=C12
MolPort-001-739-251 0.65 CCCC(=O)C1=C(OC)C=C(O)C(CC)=C1O
MolPort-001-740-422 0.65 OCC1OC(OC2=CC3=C(C(O)=C2)C(=O)C(O)C(O3)C2=CC=C(O)C=C2)C(O)C(O)C1O
MolPort-008-605-689 0.65 COC1=CC(OC)=C(C=C1)C(=O)CC(C)C
MolPort-002-663-785 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CC1)C=C2O
MolPort-039-338-247 0.65 OC[C@H]1O[C@@H](OC2=CC(O)=C3C(=O)[C@H](O)[C@H](OC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-008-515-563 0.65 CCCC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-039-056-586 0.65 COC1=CC=C(CCOC2=C(C=CC=C2)C2CC(=O)OC3=CC=C(C(=O)C4=CC=CC=C4)C(O)=C23)C=C1
MolPort-029-936-323 0.65 CC(C)(C)C(=O)N1CCC(COC2=CC=C3C(=O)CC(C)(C)OC3=C2)CC1
MolPort-000-881-238 0.65 O[C@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC1=CC=C(O)C(O)=C1
MolPort-035-701-412 0.65 COC1=CC(=CC2=C1OCCO2)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-039-338-555 0.65 CO[C@@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC1=CC=C(O)C=C1
MolPort-035-705-953 0.65 CO[C@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC1=CC=C(O)C=C1
MolPort-039-338-549 0.65 CC(C)=CCCC1(C)CCC2=C3OC(CC(=O)C3=C(O)C=C2O1)C1=C(O)C=C(O)C=C1
MolPort-001-742-089 0.65 CCCCCC1=C(C(O)=O)C2=C(CC(O)C(C)(C)O2)C(OC)=C1
MolPort-039-338-650 0.65 COC1=C2C(=O)C[C@H](OC2=C(C[C@@H](CCC(C)(C)O)C(C)=C)C(O)=C1)C1=C(O)C=C(O)C=C1
MolPort-039-337-150 0.65 COC1=C(C=CC(O)=C1)[C@@H]1CC(=O)C2=C(OC)C=C(O)C(C[C@@H](CC=C(C)C)C(C)=C)=C2O1
MolPort-002-559-652 0.65 CCCCCCCCCCCCCCCCCCOC1=C(C=CC=C1)C(=O)C(C(C)=O)C(=O)OCC
MolPort-004-056-560 0.65 COC1=CC=C(C(C)=O)C(OC(=O)CC(C2=CC=CC=C2)C2=CC=CC=C2)=C1
MolPort-003-803-581 0.65 CC1=C2OC(CCC2=CC(C=O)=C1O)C1=CC=CC=C1
MolPort-005-910-465 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N[C@H](CO)C1=CC=CC=C1)C=C2
MolPort-002-819-126 0.65 O=C1CC2(CCCCC2)OC2=CC3=CC=CC=C3C=C12
MolPort-039-338-719 0.65 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1O
MolPort-005-970-317 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC(CO)C1=CC=CC=C1)C=C2
MCULE-6945831774 0.65 C1(C)(C)OC2=C(C=CC(Br)=C2)C(=O)C1
MCULE-2982479295 0.65 C1(O)C=C2OC[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MCULE-2644639815 0.65 C1(COC2=CC=CC=C2C1=O)C1C=CC=CC=1
MCULE-5841905312 0.65 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC(C)C)=O
MCULE-8733210430 0.65 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-3334832041 0.65 C12C=C(OC)C=CC=1C(CC(C1C=CC=C(OC)C=1OC)O2)=O
MCULE-4964942191 0.65 C1C(=C(C(=C(C=1O)CC)O)C(=O)CCC)OC
MCULE-4727216318 0.65 C12(C(OC)=O)OC3=CC=C(C=C3C(=O)C1C2)CC
MCULE-5996392590 0.65 C1(O)C(OC2C(=C(O)C3=C(C=2)OC(C2C=CC(O)=CC=2)C23OC3C(C2=O)=C(O)C=C(O)C=3)C1)C1C=CC(O)=C(O)C=1
MCULE-5050298992 0.65 C1(C=CC(=CC=1OC)OC)C(C(CC)CC)=O
MCULE-6908653010 0.65 C1(C=CC(=CC=1OC)OC)C(=O)CC(C)C
MCULE-5944462948 0.65 C1(C(CCC)=O)C=CC(=CC=1OC)OC
MCULE-7481655024 0.65 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-4792540517 0.65 C1(=CC(=C2C(OC(C3=CC=C(C=C3)O)C(O)C2=O)=C1)O)OC1OC(CO)C(O)C(O)C1O
MCULE-9706081272 0.65 C1(C=CC(=CC=1OC)OC)C(C(C)CC)=O
MCULE-7269199891 0.65 C1(C=CC(=CC=1OC)OC)C(=O)C(C)(C)CC
MCULE-8212292481 0.65 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC=CC=1OCCC1C=CC(=CC=1)OC)=O
MCULE-2241769755 0.65 CC(C(N1CCC(COC2=CC3=C(C(CC(O3)(C)C)=O)C=C2)CC1)=O)(C)C
MCULE-7172292374 0.65 C1(C=CC(=CC=1OC)OC)C(=O)CC(C)(C)C
MCULE-2387149104 0.65 C12=CC(F)=CC=C1OC(CC2=O)CO
MCULE-8487893667 0.65 C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](O)C2=CC=1
MCULE-9790777412 0.65 C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@@H](OC)C2=CC=1
MCULE-3722830096 0.65 C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@H](OC)C2=CC=1
MCULE-9959174498 0.65 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C2=C(OCCO2)C=1)=O
MCULE-4202900635 0.65 C(=O)(C1=CC=CC=C1OCCCCCCCCCCCCCCCCCC)C(C(C)=O)C(OCC)=O
MCULE-7586369120 0.65 C12=C(CCC(C3=CC=CC=C3)O1)C=C(C=O)C(O)=C2C
MCULE-8799221854 0.65 COC1=CC(OC(CC(C2=CC=CC=C2)C2=CC=CC=C2)=O)=C(C(C)=O)C=C1
MCULE-4717924797 0.65 C1(O)C(C[C@H](C(=C)C)CCC(O)(C)C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(OC)C=1
MCULE-9435481307 0.65 C1(=C2CC(O)C(C)(C)OC2=C(C(=O)O)C(=C1)CCCCC)OC
MCULE-5212006601 0.65 C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3OC)CC(=O)C2=C(OC)C=1
MCULE-3547616904 0.65 C12OC(C)(CC/C=C(/C)\C)CCC1=C1OC(C3C=CC(O)=CC=3O)CC(=O)C1=C(O)C=2
MCULE-5591774685 0.65 C12=CC3C=CC=CC=3C=C1OC1(CCCCC1)CC2=O
MCULE-7161062113 0.65 C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC(=O)NC(CO)C1=CC=CC=C1
MCULE-4617683717 0.65 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-8000658254 0.65 C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(OC)C=3)CC(=O)C2=C(O)C=1OC
MCULE-2235188442 0.65 CC1=CC2=C(OCCCC2=O)C=C1
MCULE-8872050190 0.65 C12OC(C)(C)C=CC1=C1OC(C3C=CC(O)=CC=3)C(O)C(=O)C1=C(O)C=2
MCULE-3078573589 0.65 CC1=CC2=C(OCCCC2=O)C(C)=C1
MCULE-6959312962 0.65 Cl.C12=CC(OC)=CC=C1C(CC1(CCNCC1)O2)=O
MCULE-3305561128 0.65 C12(C(OC)=O)OC3=CC=C(C=C3C(=O)C1C2)C
MCULE-6509035779 0.65 C1(C(O)=O)CC2=CC=C(C=C2OC1=O)OC
MCULE-3686350370 0.65 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=C(C/C=C(/C)\C)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-9646906067 0.65 C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-1702737025 0.65 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(OC)C=1
MCULE-4980480417 0.65 C1(=C(C(=C(C(C(CCC2C=CC=CC=2)=O)=C1O)OC)CC1C(O)=CC=CC=1)O)CC1C=CC=CC=1O
MCULE-1581594019 0.65 C1(OCCCCCCCCCCCCCCCC)=CC=CC=C1C(=O)CC(=O)OC
MCULE-4551144105 0.65 C1(O)C=C2C(C(CC(C3C=CC(O)=C(C/C=C(/C)\C)C=3)O2)=O)=CC=1
MCULE-9098976055 0.65 O1C(CC2=CC=C(O)C=C12)C(O)=O
MCULE-7969907096 0.65 C12=CC(OCCN3CCCCC3)=CC=C1C(CC(C)(C)O2)=O
MCULE-3711190397 0.65 C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(N(=O)=O)=CC=1
MCULE-9449184609 0.65 C1(C(CCCCC)=O)=CC=C(C=C1O)OCCCCC
MCULE-4816184552 0.65 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCCC
MCULE-4204496934 0.65 C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)CC2=C(OC)C=1
MCULE-5025792577 0.65 C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1
MCULE-1908546351 0.65 C1(C=CC(=CC=1OC)OC)C(=O)C1CC1
MCULE-4215133965 0.65 C1(O)C=CC(C(=O)CCC2C(OC)=CC=CC=2OC)=CC=1
MCULE-6810010607 0.65 C1(O)C(C[C@@H](C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1
MCULE-5100213794 0.65 C1(O)C=CC(C(CCC2C(OC)=CC(O)=CC=2OC)=O)=CC=1
MCULE-3727519669 0.65 C1(C=CC=CC=1OC(C)C)C(CCC1C=CC=CC=1)=O
MolPort-002-464-665 0.65 CC1=CC2=C(OCCCC2=O)C=C1
MolPort-039-338-542 0.65 CC1(C)OC2=CC(O)=C3C(=O)C(O)C(OC3=C2C=C1)C1=CC=C(O)C=C1
MolPort-013-264-387 0.65 CC1=CC2=C(OCCCC2=O)C(C)=C1
MolPort-023-279-019 0.65 COC1=CC(=CC(O)=C1OC)[C@@H]1CC(=O)C2=C(O)C(OC)=C(O)C=C2O1
MolPort-008-640-980 0.65 Cl.COC1=CC2=C(C=C1)C(=O)CC1(CCNCC1)O2
MolPort-039-063-554 0.65 CCC(C)C(=O)C1=C(OC)C(C)=C(O)C(C)=C1O
MolPort-002-278-692 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=CC(=C1)[N+]([O-])=O)C=C2O
MolPort-039-338-651 0.65 CC(C)=CCC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1O
MolPort-044-754-118 0.65 CC(C)=CCC1=CC(=CC=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C(CC=C(C)C)=C2O1
MolPort-044-723-238 0.65 COC1=C2C(=O)C[C@H](OC2=C(OC)C(O)=C1)C1=C(O)C=CC=C1
MolPort-039-063-553 0.65 CC1CC(=O)C2=C(C)C=CC=C2O1
MolPort-001-741-830 0.65 COC1=C(C(=O)CCC2=CC=CC=C2)C(O)=C(CC2=C(O)C=CC=C2)C(O)=C1CC1=CC=CC=C1O
MolPort-000-165-380 0.65 CC(C)=CCC1=C(O)C=CC(=C1)C1CC(=O)C2=CC=C(O)C=C2O1
MolPort-039-338-425 0.65 COC1=CC(OC)=C2C[C@H](O)[C@H](OC2=C1)C1=CC(O)=C(OC)C=C1
MolPort-039-337-120 0.65 CC(C)=CC[C@H](CC1=C(O)C=C(O)C2=C1O[C@@H](CC2=O)C1=CC=CC=C1O)C(C)=C
MolPort-002-800-160 0.65 O=C1CC(OC2=CC=CC=C12)(C1=CC=CC=C1)C1=CC=CC=C1
MolPort-039-339-031 0.65 COC1=CC=CC(OC)=C1CCC(=O)C1=CC=C(O)C=C1
MolPort-039-339-012 0.65 CC(C)=CC[C@H](CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=C(O)C=C(O)C=C1)C(C)=C
MolPort-004-955-569 0.65 OC1=C(C=CC=C1)C1CC(=O)C2=CC=CC=C2O1
MolPort-028-610-187 0.64 COC1=C(C=C(C(O)=C1)C(C)(C)C=C)C1COC2=CC(O)=C(CC=C(C)C)C(O)=C2C1=O
MolPort-039-056-493 0.64 COC(=O)COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-046-508-985 0.64 CC(C)=CCC1=C(O)C(=CC=C1O)[C@H]1COC2=CC(O)=CC(O)=C2C1=O
MolPort-002-819-129 0.64 CC1(C)OC2=C(C=CC=C2)C(=O)C1Br
MolPort-035-701-234 0.64 COC(=O)COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-002-914-767 0.64 CC1=C(OCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C=CC2=C1OC(C)(C)CC2=O
MolPort-005-945-929 0.64 OC1CC2=C(O)C=C3OC(O)(C4=CC=C(O)C=C4)C4(OC5=C(C4=O)C(O)=CC(O)=C5)C3=C2OC1C1=CC=C(O)C=C1
MolPort-035-705-948 0.64 COC1=C(O)C=C(CC2(O)OC3=C(C2=O)C(O)=CC(O)=C3)C=C1O
MolPort-027-703-397 0.64 COC1=CC=C2CC(COC2=C1)C(=O)OCC1CCCO1
MolPort-035-700-011 0.64 COC1=CC(OC)=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-002-723-020 0.64 CC(=O)OC1C(OC2=C(C(O)=CC(OC(C)=O)=C2)C1=O)C1=CC(OC(C)=O)=C(OC(C)=O)C=C1
MolPort-039-056-558 0.64 COC1=CC(OC)=C(C=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-035-873-637 0.64 OC1=CC=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-000-150-651 0.64 O=C1CCCOC2=CC=CC=C12
MolPort-002-025-003 0.64 COC1=CC(OC)=C(C=C1)C(=O)CCC(O)=O
MolPort-000-845-167 0.64 CC(=O)N1CCC2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-005-944-811 0.64 COC1=CC=C2C(O[C@@H]3COC4=C(C=C(OC)C(OC)=C4)[C@]3(O)C2=O)=C1
MolPort-039-337-136 0.64 CC(C)=CCC1=C(O)C=C(O)C2=C1O[C@@H](CC2=O)C1=C(O)C=C(O)C=C1
MolPort-035-772-705 0.64 OC1=C(Cl)C=C2C(=O)CCOC2=C1
MolPort-000-847-209 0.64 CCCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-005-945-435 0.64 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2OCC(C(=O)C2=C1O)C1=C(O)C=C(O)C=C1
MolPort-000-855-519 0.64 CCN1CCN(CC1)C(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-005-918-854 0.64 CC(=O)N1CCN(CC1)C(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-035-705-986 0.64 COC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)C(O)O2
MolPort-001-842-611 0.64 CC1=CC(COC2=CC3=C(C(=O)CC(C)(C)O3)C(C)=C2)=C(C)C=C1
MolPort-039-056-196 0.64 OC1=C2C(CC(=O)OC2=CC=C1C(=O)C1=CC=CC=C1)C1=C(OCCC2=CC=C3OCCC3=C2)C=CC=C1
MolPort-002-512-355 0.64 CC(C)=CCC1=C(OC(C)=O)C=C(OC(C)=O)C2=C1O[C@@H](CC2=O)C1=CC=CC=C1
MolPort-008-822-103 0.64 COC1=CC2=C(OC(C)(C)CC2=O)C=C1
MolPort-000-693-542 0.64 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=C(C=C1)N1CCCC1)C=C2O
MolPort-000-701-398 0.64 CC1CC2=C(O1)C=CC(=C2)C(=O)CCC1=CC=CC=C1
MolPort-035-705-949 0.64 OC1=CC2=C(C(=O)C(O)(CC3=CC(O)=C(O)C(O)=C3)O2)C(O)=C1
MCULE-2606502445 0.64 C1C(O)=C(C(=O)CCCCC)C=CC=1OCCCCCCCCCC
MCULE-2838900881 0.64 C1(C(CCCCCCCC)=O)=CC=C(C=C1O)OCCCCCC
MCULE-9279110671 0.64 C1(C(CCCCCCCCC)=O)=CC=C(C=C1O)OCCCCCCCC
MCULE-7471184494 0.64 C12=C(C=CC3=CC(Br)=CC=C13)OCC(C)C2=O
MCULE-6183149081 0.64 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCCCCCC
MCULE-8455836455 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1=CC=C(C=C1)N1CCCC1
MCULE-3853168968 0.64 C1(C(=C2C(=CC=1O)OC1(C3C2C(C)(C)C3CC1)C)O)C(C1C=CC=CC=1)=O
MCULE-2034677841 0.64 C12(COC3=C(C=CC=C3)C1=O)CC2C1C=CC=CC=1F
MCULE-1583442011 0.64 C1(O)C(C/C=C(/C)\C)=C2O[C@H](C3C=C(C/C=C(/C)\C)C(O)=C(C/C=C(\C)/C)C=3)CC(=O)C2=CC=1
MCULE-4067098142 0.64 C12C(=C(O)C=CC=1C(=O)C[C@@H](C1C=CC(O)=C(C/C=C(/C)\C)C=1)O2)C/C=C(\C)/C
MCULE-9361535115 0.64 C1(O)C=C2OCC(C3C=CC(O)=C(C/C=C(\C)/C)C=3OC)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-4496634668 0.64 C1(O)C=C2O[C@H](C3C=CC(O)=C(OC4C=CC([C@@H]5CC(=O)C6C(O)=CC(O)=CC=6O5)=CC=4)C=3)CC(=O)C2=C(O)C=1
MCULE-9986720641 0.64 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@H](CO)[C@H](C)CC
MCULE-2672910660 0.64 C1(=CC(C)=CC=C1O)C(=O)CC(=O)C1C=CC=CC=1OC(C)C
MCULE-3248081431 0.64 C(=O)(CC(OC)=O)C1C=CC=CC=1OC(C)C
MCULE-8693767927 0.64 C12=CC(OC)=CC=C1CC(CO2)CC1=CC=C(C=C1)C(NC)=O
MCULE-3526899936 0.64 C1=C(C(CCC)=C(OCCCC(=O)O)C(=C1)C(=O)C)OCCCCl
MCULE-7823431861 0.64 C1C=C2C(=O)CC(OC2=CC=1)C1C=CC(C(=O)OC)=CC=1
MCULE-4014167599 0.64 C12=C(C)C=C(C=C1OC(CC2=O)(C)C)OCCN1CCOCC1
MCULE-5247936822 0.64 C12OC(C)(CCC(O)=O)CC(=O)C1=CC=C(OC)C=2OC
MCULE-7064992733 0.64 C(O)(=O)C(CC)CC1C=CC(=CC=1OC)OC
MCULE-6419860979 0.64 C1(C(C2C=CC=CC=2)=O)OC2=C(C=C(C=C2)C)C1=O
MCULE-5097649443 0.64 COC(C(CC(C1=C(OC)C=C(OC)C=C1)=O)=O)=O
MCULE-9921276162 0.64 CC1(OC2=C(C=CC(=C2)F)C(=O)C1)C
MCULE-2595255058 0.64 O1C2=CC(O)=CC=C2CC1C(OC)=O
MCULE-4137826956 0.64 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)SC)=O
MCULE-7136470106 0.64 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(F)C(=C(F)C=1)F)=O
MCULE-8968944056 0.64 C1(O)C(=C2OC(C3C=CC(O)=CC=3)CC(C2=C(O)C=1C1C(O)C(O)C(O)C(CO)O1)=O)C1C(O)C(O)C(O)C(CO)O1
MCULE-9286582715 0.64 COC1=CC2=C(C(CO2)CC(O)=O)C=C1
MCULE-2011738406 0.64 CC(CC1C(=O)C2=C(C=CC=C2)O1)C
MCULE-7457900902 0.64 C1(C(C)=O)=C(O)C(=C(OCC2CO2)C=C1)CCC
MCULE-3559522784 0.64 C12=CC(C)=CC=C1OC(CC2=O)C1C=CC(=CC=1)Br
MCULE-2376854494 0.64 BrC1=CC2=C(OC3(CC2=O)COC3)C=C1
MCULE-2736881086 0.64 ClC1C=C2C(=O)CC3(COC3)OC2=CC=1
MCULE-9260449258 0.64 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3OC)CC(=O)C2=C(OC)C=1
MCULE-7456571477 0.64 C12C(=CC=C3C=CC=CC=13)OCCCC2=O
MCULE-6658124858 0.64 CC(NC(COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1)=O)C
MCULE-6713247813 0.64 C1(C=CC(=CC=1OC)OC)C(=O)COC1C=CC(=CC=1)CCC
MCULE-6266626801 0.64 C1(=CC=C2C(CCCCO2)=C1)C(C)=O
MCULE-3309421841 0.64 COCC(C1C=C2CCCOC2=CC=1)=O
MCULE-8990591543 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCCC1
MCULE-2994311082 0.64 O=C1C2=CC=C3C(=C2OCCC1)C=CC=C3
MCULE-5875158888 0.64 C1(=O)C(OC(C)=O)C(C2C=CC(=C(OC(C)=O)C=2)OC(C)=O)OC2=CC(OC(C)=O)=CC(OC(C)=O)=C12
MCULE-4396859889 0.64 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC(Br)=CC=1
MCULE-1513286346 0.64 O1C(C)(C)CCC2C=C(C=O)C=CC1=2
MCULE-5769354845 0.64 C1(C=CC(OC)=CC=1O)C(=O)CC(OC)=O
MCULE-5817407631 0.64 C1(O)C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-6814312961 0.64 C1(C2C=CC=CC=2)(C2C=CC=CC=2)CC(=O)C2=C(C=CC=C2)O1
MCULE-2660644517 0.64 C1(C2C=CC=CC=2O)CC(=O)C2C(=CC=CC=2)O1
MCULE-8360387045 0.64 C1(O)C=C2OCC(C3C=C(C(C)(C)C=C)C(O)=CC=3OC)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-5194625427 0.64 C1(=O)C2=CC=CC=C2OC(C)(C)C1Br
MCULE-3981073474 0.64 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC=CC=C1OCC(OC)=O)=O
MCULE-8275106243 0.64 C12OC(CC(=O)C=1C=CC(OCC1=CC(=CC(C(F)(F)F)=C1)C(F)(F)F)=C2C)(C)C
MCULE-6509194251 0.64 C1C(O)=C2C(=O)[C@@H](C3C(O)=C(C/C=C(\C)/C)C(O)=CC=3)COC2=CC=1O
MCULE-1537503458 0.64 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC=CC=1OCC(OC)=O)=O
MCULE-2538844083 0.64 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(OC)=C(O)C=1
MCULE-7548939352 0.64 C12(C(OC)=O)OC3=CC=CC=C3C(=O)C1C2
MCULE-9443831383 0.64 C1C(O)=C2CC(O)C(C3C=CC(O)=CC=3)OC2=C2C3(OC4C=C(O)C=C(O)C=4C3=O)C(O)(C3C=CC(O)=CC=3)OC=12
MCULE-5711074607 0.64 C12(C(O)=O)CC1C1C(=CC(=CC=1)OC)OC2=O
MCULE-9936156290 0.64 C1=C(OC)C=CC(=C1OC)C(CC(C)(C(=O)O)C)=O
MCULE-2101839314 0.64 COC1=CC2=C(CC(C(OCC3OCCC3)=O)CO2)C=C1
MCULE-2844946240 0.64 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC=C(O)C=1)=O
MCULE-9737695619 0.64 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-3306504776 0.64 C12=CC(=CC=C1C(CC1(CCN(CC1)C(C)=O)O2)=O)OCC(O)=O
MCULE-7113486032 0.64 O=C1C2=C(C=CC=C2)OCCC1
MCULE-6416168758 0.64 C1(=CC=C(C=C1OC)OC)C(CCC(O)=O)=O
MCULE-5018725458 0.64 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-7845274541 0.64 C1(=O)C(OC(C)=O)C(C2=CC=C(C(OC(C)=O)=C2)OC(C)=O)OC2C=C(OC(C)=O)C=C(O)C1=2
MCULE-9912319515 0.64 C1C=C2C(O[C@]3([H])COC4C=C(OC)C(OC)=CC=4[C@]3(O)C2=O)=CC=1OC
MCULE-7617295584 0.64 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-7975437420 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCN(CC1)CC
MCULE-1780868352 0.64 OC1C=C(C(=CC=1)C1COC2C(=C(O)C(C/C=C(\C)/C)=C(C=2C/C=C(\C)/C)O)C1=O)O
MCULE-2777928047 0.64 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(NCCCC)=O
MCULE-2186114470 0.64 C1(C(CC)=O)=CC=C(C=C1O)OCCCC
MCULE-3341716045 0.64 C1(OC)C=C2OC(O)[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MCULE-8960596008 0.64 C12OC(CC(=O)C=1C(C)=CC(OCC1C=C(C=CC=1C)C)=C2)(C)C
MCULE-6813410114 0.64 C12=CC(OCC3C=CC=CC=3)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC=CC=1
MCULE-6465135397 0.64 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC=CC=1OCCC1C=CC2=C(CCO2)C=1)=O
MCULE-9997080281 0.64 COC1=CC2=C(OC(CC2=O)(C)C)C=C1
MCULE-3336281649 0.64 CC1C(=O)C2=C(C=C3C(=C2)CCO3)O1
MCULE-3429694341 0.64 O1C(C2=CC=C(C=C2)N(=O)=O)C(O)C(C2=CC=C(Br)C=C12)=O
MCULE-8169575133 0.64 C12C(C/C=C(/C)\C)=C(OC(C)=O)C=C(OC(C)=O)C=1C(C[C@@H](C1C=CC=CC=1)O2)=O
MCULE-9462328387 0.64 C1(C2OC3C(=C(OC(C)=O)C=C(C=3C/C=C(\C)/C)OC(C)=O)C(=O)C2)=CC=CC=C1
MCULE-8744659707 0.64 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(O)=C(O)C=1
MCULE-9463670847 0.64 C12(C3C=CC=CC=3)C(=O)C3C=CC(=CC=3OC1(O2)C)OC
MCULE-4242616899 0.64 C1(C(CCCCCCCCCCC)=O)C=CC(=CC=1O)OCCCCCCCCCC
MCULE-4208394266 0.64 C1(C(CCCCCC)=O)C=CC(=CC=1O)OCCCCCC
MCULE-1129507897 0.64 C12CC(OC=1C=CC(C(CCC1C=CC=CC=1)=O)=C2)C
MolPort-001-741-597 0.64 CC1(C)C2CCC3(C)OC4=CC(O)=C(C(=O)C5=CC=CC=C5)C(O)=C4C1C23
MolPort-002-857-770 0.64 FC1=C(C=CC=C1)C1CC11COC2=CC=CC=C2C1=O
MolPort-018-503-802 0.64 CC(C)OC1=C(C=CC=C1)C(=O)CC(=O)C1=C(O)C=CC(C)=C1
MolPort-028-610-188 0.64 COC1=C(C=CC(O)=C1CC=C(C)C)C1COC2=CC(O)=C(CC=C(C)C)C(O)=C2C1=O
MolPort-046-156-414 0.64 CC(C)=CCC1=C(O)C=CC(=C1)[C@@H]1CC(=O)C2=C(O1)C(CC=C(C)C)=C(O)C=C2
MolPort-046-153-774 0.64 CC(C)=CCC1=CC(=CC(CC=C(C)C)=C1O)[C@@H]1CC(=O)C2=CC=C(O)C(CC=C(C)C)=C2O1
MolPort-039-052-621 0.64 OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=C(OC3=C(O)C=CC(=C3)[C@@H]3CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2)C(O)=C1
MolPort-039-058-099 0.64 CC[C@@H](C)[C@@H](CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-028-735-185 0.64 CNC(=O)C1=CC=C(CC2COC3=C(C2)C=CC(OC)=C3)C=C1
MolPort-008-441-963 0.64 COC1=C(OC)C2=C(C=C1)C(=O)CC(C)(CCC(O)=O)O2
MolPort-000-870-644 0.64 COC(=O)C(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-022-452-216 0.64 CC1(C)CC(=O)C2=C(O1)C=C(F)C=C2
MolPort-028-777-294 0.64 COC(=O)C1CC2=CC=C(O)C=C2O1
MolPort-002-816-188 0.64 CC1=CC=C2OC(C(=O)C3=CC=CC=C3)C(=O)C2=C1
MolPort-035-702-553 0.64 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC(F)=C(F)C(F)=C4)C3=C2O1
MolPort-019-936-990 0.64 OCC1OC(C(O)C(O)C1O)C1=C(O)C(C2OC(CO)C(O)C(O)C2O)=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-035-700-627 0.64 CSC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-683-119 0.64 COC1=C(C=CC=C1)[C@@H]1CC(=O)C2=C(OC)C=C(O)C(OC)=C2O1
MolPort-035-689-359 0.64 CCC1(CC2=C(O1)C=CC=C2)C(O)=O
MolPort-027-708-604 0.64 COC1=CC=C2C(CC(O)=O)COC2=C1
MolPort-044-182-304 0.64 BrC1=CC2=C(OC3(COC3)CC2=O)C=C1
MolPort-000-671-069 0.64 CC1=CC2=C(OC(CC2=O)C2=CC=C(Br)C=C2)C=C1
MolPort-000-843-169 0.64 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCCC1)C=C2O
MolPort-009-110-855 0.64 CC(C)NC(=O)COC1=CC=C2C(=O)CC3(CCCCC3)OC2=C1
MolPort-001-795-792 0.64 CCCC1=CC=C(OCC(=O)C2=C(OC)C=C(OC)C=C2)C=C1
MolPort-013-264-339 0.64 O=C1CCCOC2=C1C=CC1=CC=CC=C21
MolPort-002-915-231 0.64 CC1=CC(OCC2=CC=C(Br)C=C2)=CC2=C1C(=O)CC(C)(C)O2
MolPort-030-005-232 0.64 OC1=CC2=C(C=C1F)C(=O)CCO2
MolPort-039-052-593 0.64 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
MolPort-000-144-689 0.64 CC1(C)CCC2=C(O1)C=CC(C=O)=C2
MolPort-000-004-267 0.64 COC(=O)CC(=O)C1=C(O)C=C(OC)C=C1
MolPort-028-754-113 0.63 COC1=CC(O)=CC=C1[C@@H]1CC(=O)C2=C(O1)C(C[C@@H](CC=C(C)C)C(C)=C)=C(O)C=C2O
MolPort-027-879-580 0.63 COC1=CC2=C(CC(CC3=CC=C(CC(N)=O)C=C3)CO2)C=C1
MolPort-006-132-621 0.63 O=C1COC2=C(C=CC=C2)C(=O)C1
MolPort-039-338-490 0.63 COC1=C(CCC(=O)C2=CC=C(O)C=C2)C=CC(O)=C1
MolPort-001-741-374 0.63 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-006-668-668 0.63 OCC1OC(C(O)C(O)C1O)C1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-046-790-344 0.63 COC1=C(CCC(=O)C2=CC=C(O)C=C2)C(O)=CC(O)=C1
MolPort-002-818-069 0.63 CCC(CO)C(=O)C1=C(O)C=C(OCC2=CC=CC=C2)C=C1
MolPort-020-167-517 0.63 CC1=CC2=C(C=C1C)C(=O)CCO2
MolPort-035-701-394 0.63 COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-013-264-384 0.63 CC(C)C1=CC=CC2=C1OCCCC2=O
MolPort-008-771-415 0.63 COC(=O)CCC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-001-842-615 0.63 CC1=C(OCC2=C(Cl)C=C(Cl)C=C2)C=CC2=C1OC(C)(C)CC2=O
MolPort-001-842-620 0.63 CC1=C(OCC2=CC=CC(OC(F)(F)F)=C2)C=CC2=C1OC(C)(C)CC2=O
MolPort-005-945-434 0.63 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2OCC(C(=O)C2=C1)C1=CC=C(O)C=C1O
MolPort-028-727-878 0.63 COC1=CC2=C(CC(CC3=C(C=CC=C3)C(N)=O)CO2)C=C1
MolPort-035-873-801 0.63 COC1=C(O)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-873-879 0.63 OC(=O)C1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-772-656 0.63 Cl.OC1=CC=C2C(=O)CC3(CCNCC3)OC2=C1
MolPort-020-233-795 0.63 CC1(C)CC(=O)C2=CC(Br)=CC=C2O1
MolPort-027-878-637 0.63 COC1=CC2=C(CC(CC3=C(OCC(N)=O)C=CC(C)=C3)CO2)C=C1
MolPort-000-854-746 0.63 CN(CC1=CC=CC=C1)C(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-003-804-009 0.63 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC(OC)=C2
MolPort-008-612-243 0.63 CCCCOC1=C(C=C(C)C=C1)C(=O)CC
MolPort-039-101-213 0.63 COC1=CC2=C(C=C1OC)C1(O)C(CO2)OC2=C3CC(OC3=CC=C2C1=O)C(C)(C)O
MolPort-035-683-128 0.63 COC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=C(O)C=CC=C1
MolPort-039-101-212 0.63 COC1=CC2=C(C=C1OC)C1(O)C(CO2)OC2=C3CC(OC3=CC=C2C1=O)C(C)(O)CO
MolPort-011-483-892 0.63 CCC(=O)C1=CC2=C(OCCC2)C=C1
MolPort-000-854-634 0.63 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC1=CC=CC=C1)C=C2O
MolPort-021-804-790 0.63 COC1=CC2=C(C=C1OC)[C@@]1(O)[C@@H](CO2)OC2=C3C[C@@H](OC3=CC=C2C1=O)C(C)(C)O
MolPort-002-536-516 0.63 CC(NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1)C1=CC=CC=C1
MolPort-002-227-100 0.63 COC1=CC=C2C(=O)CC(O)(OC2=C1)C(F)(F)C(F)(F)F
MolPort-034-898-928 0.63 O=C1CC2(CCOC2)OC2=CC=CC=C12
MolPort-002-153-169 0.63 COC1=CC=C2C(=O)CC(O)(OC2=C1)C(F)(F)C(F)F
MolPort-035-779-775 0.63 CCC(=O)C1=C(OCCC(C)C)C=CC(C)=C1
MolPort-005-910-761 0.63 COCCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-004-858-962 0.63 CN(C)CC(C)(C)CNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-022-383-381 0.63 COC1=CC2=C(C=C1)C(CCO2)C(O)=O
MolPort-009-755-191 0.63 CCOC(=O)C1OC2=C(C=CC=C2)C1=O
MolPort-000-165-373 0.63 COC1=CC(O)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1
MolPort-002-818-053 0.63 COC1=CC(O)=C(C=C1)C(=O)CCC1=CC=CC=C1
MolPort-005-945-117 0.63 COC1=CC(O)=C(C(=O)CCC2=CC=C(O)C=C2)C(O)=C1
MCULE-5974617735 0.63 C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3OC)CC(=O)C2=C(O)C=1
MCULE-2128104276 0.63 C12=CC(OC)=CC=C1CC(CO2)CC1C=CC(=CC=1)CC(N)=O
MCULE-5775761807 0.63 C1(O)C=CC(C(=O)CCC2C=CC(O)=CC=2OC)=CC=1
MCULE-6030144398 0.63 O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1C1C(=C2C(=O)C[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)O)CO
MCULE-4597198409 0.63 OC1C(O)C(O)C(OC1C1C(=C2C(=O)CC(C3C=CC(O)=CC=3)OC2=CC=1O)O)CO
MCULE-7985870026 0.63 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC=CC=1OC)=O
MCULE-8427094049 0.63 FC1C=C2OC3(COC3)CC(=O)C2=CC=1
MCULE-9576974382 0.63 CCCC1C2OCCCC(=O)C=2C=CC=1
MCULE-5041167977 0.63 C1(C=CC(=CC=1OC)OC)C(CCC(OC)=O)=O
MCULE-8549612273 0.63 C1(C(CCCCC)=O)C=CC(=CC=1O)OCC(O)=O
MCULE-5680979195 0.63 C1(C(CCCCCCCCC)=O)C=CC(=CC=1O)OCC(O)=O
MCULE-3827391207 0.63 CC(C1=C2C(C(CCCO2)=O)=CC=C1)C
MCULE-5544320339 0.63 C1(C(CCCCCC)=O)=CC=C(C=C1O)OCC(O)=O
MCULE-7607710461 0.63 C1(C=CC(=CC=1O)OCC1C=CC=CC=1)C(=O)C(CC)CO
MCULE-8045809230 0.63 CC1=C(C)C=C2C(OCCC2=O)=C1
MCULE-8640003899 0.63 C12OC(CC(=O)C=1C=CC(OCC1C=CC(Cl)=CC=1Cl)=C2C)(C)C
MCULE-9729620311 0.63 OC1C=C(C(C2COC3C(=CC(C/C=C(\C)/C)=C(C=3C/C=C(\C)/C)O)C2=O)=CC=1)O
MCULE-6122035709 0.63 C12C(=O)CC(C)(C)OC=1C(C)=C(C=C2)OCC1=CC=CC(OC(F)(F)F)=C1
MCULE-1040954793 0.63 O1C2C=CC=CC=2C(CC1C1C=CC=C(O)C=1)=O
MCULE-9974166516 0.63 C12=CC(OC)=CC=C1CC(CO2)CC1C=CC=CC=1C(N)=O
MCULE-8873094676 0.63 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=CC=1)C(O)=O)=O
MCULE-1528499595 0.63 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(O)C=1)OC)=O
MCULE-3331357688 0.63 C1OC2=C(C=C(C)C=C2)CC1C(O)=O
MCULE-5028808858 0.63 C1(OCCCCCCCCCCCCCCCC)=CC(=CC=C1C(=O)C)OC
MCULE-4027254016 0.63 C1(OCCCCCCCCCC)=CC(=CC=C1C(=O)C)OCCCCCCCCCC
MCULE-6793039677 0.63 CC1(OC2=C(C=C(C=C2)Br)C(=O)C1)C
MCULE-9899442301 0.63 C12=CC(OC)=CC=C1CC(CO2)CC1C=C(C)C=CC=1OCC(N)=O
MCULE-1243164622 0.63 C12C=C(OC)C=CC=1OC(C1=CC=C(OC)C=C1)CC2=O
MCULE-1833831797 0.63 C1(=CC(C)=CC=C1OCCCC)C(CC)=O
MCULE-2076652108 0.63 C1(C=C(C)C=CC=1OCCC(C)C)C(CC)=O
MCULE-5270597482 0.63 C1(C=CC(=CC=1OC)OC)C(C(C)CCC)=O
MCULE-4654878902 0.63 CCC(C1=CC2=C(OCCC2)C=C1)=O
MCULE-8752073997 0.63 C1(OC)=C(C=CC(OCC)=C1)CCC(OC)=O
MCULE-3179295143 0.63 C1(C(CCCC)=O)C=CC(=CC=1OC)OC
MCULE-7277320014 0.63 C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(C)C)OC=12
MCULE-3642569299 0.63 C1C=C2C(=O)[C@@]3(O)C4C=C(OC)C(OC)=CC=4OC[C@@]3([H])OC2=C2C[C@H](C(O)(C)C)OC=12
MCULE-5872540603 0.63 C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(CO)C)OC=12
MCULE-7622000740 0.63 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N(C)CC1C=CC=CC=1
MCULE-2558390897 0.63 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NCC1C=CC=CC=1
MCULE-9536770631 0.63 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCCCOC)=O
MCULE-6963051080 0.63 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)NCC(C)(C)CN(C)C
MCULE-6860043488 0.63 C1(O)(CC(=O)C2=C(C=C(C=C2)OC)O1)C(F)(F)C(F)F
MCULE-4848618343 0.63 C1(O)(CC(=O)C2C(=CC(=CC=2)OC)O1)C(F)(F)C(F)(F)F
MCULE-9922758733 0.63 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1
MCULE-6968489213 0.63 C(OC)(=O)CC1C2=CC=C(OC)C=C2OC1
MCULE-6336853147 0.63 C1(CC(=O)C2=C(OC)C=C(OC)C=C2)OCCO1
MCULE-7132233293 0.63 C12C=CC(=CC=1OCCC2C(O)=O)OC
MCULE-1889425014 0.63 C1=CC=C2C(C(=O)C(C(=O)OCC)O2)=C1
MCULE-7230200880 0.63 C1(C=CC(=CC=1O)OC)C(CCC1C=CC=CC=1)=O
MCULE-2743643469 0.63 C1(C(C)=O)=CC=C(C=C1O)OCC(CC)O
MCULE-3844561245 0.63 C1(OC)=CC(O)=C(C(O)=C1)C(CCC1C=CC=CC=1)=O
MCULE-2319927102 0.63 C1=C(OC)C=CC(CCC(=O)C2C(OC)=CC=CC=2)=C1
MCULE-7435145283 0.63 C1=C(OC)C=CC(C(=O)CCCCCCC(=O)O)=C1OC
MCULE-2069504113 0.63 C1(O)C=CC(C(=O)CCC2C(OC)=CC(O)=C(C(C3C=CC(OC)=CC=3)CCC3C=CC(O)=CC=3OC)C=2)=CC=1
MCULE-2217052177 0.63 C1=C(OC)C=CC(C(=O)CCCCCC(=O)O)=C1OC
MCULE-5745942938 0.63 C1=C(OC)C=CC(C(=O)CCCCC(=O)O)=C1OC
MCULE-8221556032 0.63 C12=CC=CC(C)=C1OCCCC2=O
MCULE-8810069198 0.63 C12C(OC(C)=O)=CC(=CC=1OC(CC2=O)C1C=CC(=C(OCC2C=CC=CC=2)C=1)OCC1C=CC=CC=1)OC(C)=O
MCULE-8739063782 0.63 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-3655039815 0.63 C1(C=CC=CC=1OCC(O)CNC(C)(C)C)C(CCC1C=CC=CC=1)=O
MCULE-2119697853 0.63 C12(CCOCC1)OC1=CC=CC=C1C(=O)C2
MCULE-2907122875 0.63 C1(C=CC=CC=1OCC(O)CN(CC)CC)C(CCC1C=CC=CC=1)=O
MCULE-6553541880 0.63 C1(O)(C(OC)=O)CC(=O)C2C(=CC=CC=2)O1
MCULE-1366630724 0.63 C1(OC)C=C2O[C@H](C3C=CC(O)=C(OC)C=3)[C@H](O)CC2=C(OC)C=1
MCULE-3995076938 0.63 C12=CC(Br)=CC=C1OC(CC2=O)C(O)=O
MCULE-3898266825 0.63 OC(C1OC2=C(C=C(C=C2)Cl)C(=O)C1)=O
MCULE-8300710193 0.63 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@H](CO)CC1C=CC=CC=1
MCULE-6829744393 0.63 C1(C=C(C)C=CC=1OCCCCC)C(CC)=O
MCULE-3994559440 0.63 C1C(O)=C(C(=O)CCCCCCCCC)C=CC=1OCCC
MCULE-7521672729 0.63 CN(C(COC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)=O)CC1CC1
MCULE-5687409494 0.63 NC(C1=CC=C(COC2=CC3=C(C(CC4(O3)CCCCC4)=O)C=C2)C=C1)=O
MCULE-9298140592 0.63 O1C2C=CC=CC=2C(C[C@]1([H])C1=CC=C2C(OCCO2)=C1)=O
MCULE-1480965270 0.63 C12C(CCC(C)(C)O1)=CC=C(O)C=2C
MCULE-2855348039 0.63 C1(OC)=C(C=CC(OCC)=C1)CCC(O)=O
MCULE-8622468617 0.63 C1(C=C(C)C=CC=1OC)C(CCC1C=CC=CC=1)=O
MCULE-5605893366 0.63 CC1=C(C)C2=C(OCCC2=O)C=C1
MCULE-8903546853 0.63 CC1=CC2=C(OC(C(O)=O)CC2)C=C1
MCULE-5102175942 0.63 C1(C(CCCCC(OC)=O)=O)C=CC(=CC=1OC)OC
MCULE-2316302341 0.63 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)[C@H](O)C2=CC=1
MCULE-2424476488 0.63 C12C=C(O)C=CC=1OC(CC2=O)C1=CC=CC=C1
MCULE-6014567598 0.63 C(=O)(N(C)C)C1C=CC=C(CC2COC3C(=CC=C(OC)C=3)C2)C=1
MCULE-4105207010 0.63 C12=CC(OC)=CC=C1CC(CO2)CC1=CC=CC(=C1)C(NC)=O
MCULE-6451111457 0.63 C12C=C(O)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MCULE-5176617941 0.63 C1(OC)C=C2OC[C@@H](C3C(O)=CC(OC)=CC=3)CC2=CC=1
MCULE-8245121720 0.63 C(C(OCC)=O)(C(OCC)=O)CC1C(OCCC)=CC=C(C(C)=O)C=1
MCULE-1268574882 0.63 C1([C@H]([C@H](C2=CC(C(C)=O)=CC=C2O1)N)O)(C)C
MCULE-3729322321 0.63 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCCCC1
MCULE-1315260785 0.63 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NCC1C=CC(=CC=1)OC
MCULE-8627130683 0.63 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC1CCCC1
MCULE-2453281985 0.63 C12OC(CC(=O)C=1C=CC(OCC(=O)NCC=C)=C2C)(C)C
MCULE-7574811466 0.63 O1C2=C(C=CC3=C2C[C@H](C(=C)C)O3)C([C@@H]2C3=CC(=C(C=C3OC[C@@H]12)OC)OC)=O
MCULE-9222232228 0.63 C(C)(=C)C1CC2=C(C=CC3C(C4(C5C=C(OC)C(OC)=CC=5OCC4([H])OC=32)[H])=O)O1
MCULE-7415617623 0.63 C12O[C@]3([H])COC4=C(C=C(C(OC)=C4)OC)[C@@]3(C(=O)C1=CC=C1C=2C[C@@H](O1)C(C)=C)[H]
MCULE-7287067191 0.63 C12O[C@]3([H])COC4C(=CC(=C(OC)C=4)OC)[C@@]3(C(=O)C1=CC=C1C=2C[C@@H](O1)C(C)=C)[H]
MolPort-039-338-285 0.63 COC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C(CC=C(C)C)=C2O1
MolPort-004-622-524 0.63 CC1=CC=CC2=C1OCCCC2=O
MolPort-002-534-485 0.63 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1=CC=C(CCO)C=C1)C=C2O
MolPort-020-005-776 0.63 COC1=CC=C(C=C1)C(CCC1=CC=C(O)C=C1OC)C1=CC(CCC(=O)C2=CC=C(O)C=C2)=C(OC)C=C1O
MolPort-002-823-531 0.63 CC(=O)OC1=CC2=C(C(=O)CC(O2)C2=CC(OCC3=CC=CC=C3)=C(OCC3=CC=CC=C3)C=C2)C(OC(C)=O)=C1
MolPort-039-052-458 0.63 COC1=CC(OC)=C2C[C@@H](O)[C@H](OC2=C1)C1=CC(OC)=C(O)C=C1
MolPort-002-159-890 0.63 CCN(CC)CC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-016-679-684 0.63 O=C1CC2(CCOCC2)OC2=C1C=CC=C2
MolPort-035-385-767 0.63 OC1=C(F)C2=C(C=C1)C(=O)CCO2
MolPort-003-762-737 0.63 OC(=O)C1CC(=O)C2=C(O1)C=CC(Cl)=C2
MolPort-003-001-049 0.63 CC(C)(C)NCC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-039-056-242 0.63 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N[C@H](CO)CC1=CC=CC=C1)C=C2O
MolPort-035-780-985 0.63 CCCCCOC1=C(C=C(C)C=C1)C(=O)CC
MolPort-009-353-068 0.63 NC(=O)C1=CC=C(COC2=CC=C3C(=O)CC4(CCCCC4)OC3=C2)C=C1
MolPort-002-510-392 0.63 O=C1C[C@@H](OC2=C1C=CC=C2)C1=CC2=C(OCCO2)C=C1
MolPort-020-051-713 0.63 CN(CC1CC1)C(=O)COC1=CC=C2C(=O)CC(C)(C)OC2=C1
MolPort-003-710-537 0.63 O=C1CC(=O)C2=C(O1)C=CC=C2
MolPort-035-742-817 0.63 CC1=CC=C2OC(CCC2=C1)C(O)=O
MolPort-039-052-612 0.63 O[C@H]1[C@H](O)C2=CC=C(O)C=C2O[C@@H]1C1=CC=C(O)C=C1
MolPort-034-900-902 0.63 BrC1=CC=C2C(=O)CC3(CCC3)OC2=C1
MolPort-028-740-495 0.63 CNC(=O)C1=CC(CC2COC3=C(C2)C=CC(OC)=C3)=CC=C1
MolPort-028-741-009 0.63 COC1=CC=C2CC(CC3=CC=CC(=C3)C(=O)N(C)C)COC2=C1
MolPort-001-792-222 0.63 OC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
MolPort-003-803-585 0.63 CC1=C2OC(C)(C)CCC2=CC=C1O
MolPort-046-596-299 0.63 OC1=CC2=C(O[C@@H](CC2=O)C2=CC=CC=C2)C=C1
MolPort-020-093-193 0.63 CC1=CC=C2OCCC(=O)C2=C1C
MolPort-039-052-655 0.63 COC1=CC=C([C@@H]2COC3=CC(OC)=CC=C3C2)C(O)=C1
MolPort-002-584-263 0.63 CCCOC1=CC=C(C=C1CC(C(=O)OCC)C(=O)OCC)C(C)=O
MolPort-000-860-117 0.63 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCCCC1)C=C2O
MolPort-000-859-783 0.63 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CCCC1)C=C2O
MolPort-001-794-641 0.63 COC1=C(OC)C=C2C3C(COC2=C1)OC1=C(C=CC2=C1CC(O2)C(C)=C)C3=O
MolPort-002-507-351 0.63 COC1=C(OC)C=C2[C@H]3[C@@H](COC2=C1)OC1=C(C=CC2=C1C[C@@H](O2)C(C)=C)C3=O
MolPort-016-633-338 0.63 COC1=CC2=C(C=C1OC)[C@H]1[C@@H](CO2)OC2=C(C=CC3=C2CC(O3)C(C)=C)C1=O
MolPort-002-914-795 0.63 CC1=C(OCC(=O)NCC=C)C=CC2=C1OC(C)(C)CC2=O
MolPort-000-857-157 0.63 COC1=CC=C(CNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-002-534-765 0.63 CC(CCC1=CC=CC=C1)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-002-535-446 0.63 COC1=CC=C(CCNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-006-417-459 0.63 CCCC1=C(O)C(=CC=C1OCCCCC#N)C(C)=O
MolPort-001-740-421 0.63 O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC(O)=C(O)C(O)=C1
MolPort-001-740-277 0.63 O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C(O)=C1
MolPort-038-979-355 0.63 CC1=CC=CC(OCCNC(=O)COC2=CC=CC3=C2C(=O)CC(C)(C)O3)=C1
MolPort-001-740-232 0.63 O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C(O)=C1
MolPort-005-694-804 0.63 CC(=O)C1=CC=CC=C1OCCOC(=O)C1CC2=CC=CC=C2O1
MolPort-001-824-840 0.63 OC1CC2=C(OC1C1=CC(O)=C(O)C=C1)C=C(O)C=C2O
MolPort-001-740-311 0.63 O[C@H]1CC2=C(O)C=C(O)C=C2O[C@H]1C1=CC(O)=C(O)C(O)=C1
MolPort-004-963-948 0.63 O.OC1CC2=C(OC1C1=CC(O)=C(O)C=C1)C=C(O)C=C2O
MolPort-003-941-524 0.63 O[C@@H]1CC2=C(O[C@H]1C1=CC(O)=C(O)C(O)=C1)C=C(O)C=C2O
MolPort-046-766-138 0.63 C.CO.O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@H]1C1=CC(O)=C(O)C(O)=C1
MolPort-003-935-517 0.63 O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@H]1C1=CC(O)=C(O)C=C1
MolPort-003-928-035 0.63 O.O[C@H]1CC2=C(O[C@@H]1C1=CC(O)=C(O)C=C1)C=C(O)C=C2O
MolPort-046-417-443 0.63 C.O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C(O)=C1
MolPort-003-665-790 0.63 O[C@@H]1CC2=C(O[C@@H]1C1=CC(O)=C(O)C(O)=C1)C=C(O)C=C2O
MolPort-002-834-811 0.62 COC1=CC2=C(C[C@@H](O)[C@@H](O2)C2=CC(OC)=C(OC)C=C2)C(OC)=C1
MolPort-002-160-156 0.62 Cl.CC(C)(C)NCC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-000-882-101 0.62 CC1(C)CCC2=CC=C(O)C=C2O1
MolPort-039-052-335 0.62 CCCC(=O)C1=C(O)C(CC2=C(O)C(CC3=C(O)C(C(=O)CCC)=C(OC)C(C)=C3O)=C(O)C(C(=O)C(C)CC)=C2O)=C(O)C(C)=C1OC
MolPort-008-645-058 0.62 CC1=C(C)C2=C(C=C1)C(=O)CCO2
MolPort-039-339-086 0.62 CCCC(=O)C1=C(O)C(CC2=C(O)C(C(=O)CCC)=C(OC)C(C)=C2O)=C(O)C(C)=C1OC
MolPort-001-742-520 0.62 COC1=CC(O)=C(C(=O)CCC2=CC=C(OC)C(OC)=C2)C(OC)=C1
MolPort-046-508-976 0.62 CC(C)=CCC1=C(O)C(=CC=C1O)[C@H]1COC2=C(CC=C(C)C)C(O)=CC(O)=C2C1=O
MolPort-035-873-411 0.62 COC1=C(O)C=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-007-926-789 0.62 CCOC(=O)COC1=CC2=C(OC(C)(C)CC2=O)C=C1
MolPort-002-278-691 0.62 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC=C(C=C1)[N+]([O-])=O)C=C2O
MolPort-035-700-574 0.62 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC5=C(OCO5)C=C4)C3=C2O1
MolPort-002-511-184 0.62 O=C1CC(OC2=C1C=CC1=CC=CC=C21)C1=CC2=C(OCCO2)C=C1
MolPort-035-874-004 0.62 COC1=CC(=CC(OC)=C1O)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-001-764-980 0.62 O=C(C1OC1C1=CC=CC=C1)C1=CC=CC=C1OCC1=CC=CC=C1
MolPort-039-360-932 0.62 CN1C=C(CCOC2=CC=C3C(=O)CC(C)(C)OC3=C2)C=N1
MolPort-002-834-813 0.62 COC(CC1=C(OCC2=CC=CC=C2)C=C(OC)C=C1)C(O)C1=CC=CC=C1
MolPort-027-857-915 0.62 COC1=C(C=C(CC2COC3=CC=CC=C3C2)C=C1)C(N)=O
MolPort-044-184-414 0.62 Cl.NCC1CC(=O)C2=C(O1)C=CC=C2
MolPort-002-910-633 0.62 CCCCCCCCCCCCCCCCCCOC1=C(C=CC=C1)C(=O)CC(=O)OCC
MolPort-002-499-613 0.62 CC1(C)CC(=O)C2=CC(N)=CC=C2O1
MolPort-039-339-000 0.62 CC(C)=CCC\C(C)=C\CC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-029-206-399 0.62 OC(=O)CC1CC2=C(O1)C=C(O)C=C2
MolPort-005-916-142 0.62 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCC(CC3=CC=CC=C3)CC1)C=C2O
MolPort-020-375-396 0.62 CC(=O)C1=CC=C2OCCCC2=C1
MolPort-002-535-266 0.62 CC1=CC=C(CNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-005-912-446 0.62 CN(CCC#N)C(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-004-365-556 0.62 CCOC(=O)C(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-000-671-075 0.62 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(C)C=C2C
MolPort-002-507-341 0.62 CC1(C)CCC2=C(O1)C=CC(CC(O)=O)=C2
MolPort-006-417-663 0.62 CC1=C2C(=O)CCOC2=CC=C1
MCULE-1778800371 0.62 [C@@H]1(OC2=C(C(O)=CC(O)=C2)C(=O)[C@]1([H])O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)C1=CC=C(O)C=C1
MCULE-1164343900 0.62 [H]Cl.C12(CCNCC1)OC1=CC=CC(O)=C1C(=O)C2
MCULE-6222243118 0.62 C1=C(OC)C=CC(C(=O)CCC(=O)OCC)=C1OC
MCULE-7046687063 0.62 OC(C1OC2=C(C=C(C=C2)F)C(=O)C1)=O
MCULE-3938369351 0.62 C1(CC(C2C=C(C=CC=2O1)Cl)=O)C1=CC=C(OC)C=C1
MCULE-6592133711 0.62 CC1C(O)C(O)C(O)C(OC2C(=O)C3C(=CC(=CC=3O)O)OC2C2C=CC(O)=CC=2)O1
MCULE-9527875629 0.62 C1=C(O)C2=C(O[C@@H]([C@H](C2=O)O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)C2=CC=C(O)C=C2)C=C1O
MCULE-7943994885 0.62 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1
MCULE-7739441189 0.62 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC(=CC=1)OCCC1=CC=C2C(CCO2)=C1)=O
MCULE-3258174363 0.62 C1OC2=C(C=C(C(O)=O)C=C2)C(=O)C1
MCULE-2933865577 0.62 O=C1CC2(CC3=CC=CC=C3OC2)OC1
MCULE-1532117250 0.62 C1C(O)=C2C[C@@H]([C@H](OC2=CC=1O)C1C=C(O)C(O)=CC=1)O
MCULE-3245144995 0.62 OC1=CC(O)=C2C(O[C@@H]([C@H](O)C2)C2C=C(O)C(O)=C(O)C=2)=C1
MCULE-7711257189 0.62 CC1=CC(OCCNC(COC2=C3C(OC(CC3=O)(C)C)=CC=C2)=O)=CC=C1
MCULE-6012305666 0.62 C1(C=CC(=CC=1OC)OC)C(C(CCC)CCC)=O
MCULE-3544812749 0.62 O1CCCC(=O)C2=CC(Cl)=C(O)C=C12
MCULE-9971134031 0.62 C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1
MCULE-4219942050 0.62 O1C(C(O)CC2C(=CC(O)=CC1=2)O)C1C=CC(O)=C(O)C=1
MCULE-6604166498 0.62 C1(C=CC(=CC=1OC)OC)C(C1CCC1)=O
MCULE-8436122228 0.62 [C@@H]1([C@H](O)CC2C(O)=CC(O)=CC=2O1)C1=CC(=C(O)C(O)=C1)O
MCULE-1292125513 0.62 O1[C@@H]([C@H](O)CC2C(=CC(O)=CC1=2)O)C1=CC=C(C(O)=C1)O
MCULE-9338438267 0.62 C1(O)C=C2O[C@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-9354240076 0.62 OC1=CC(=C2C(=C1)O[C@@H]([C@H](C2)O)C1=CC=C(C(=C1)O)O)O
MCULE-5749472487 0.62 C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1
MCULE-8775451204 0.62 C1C(O)=C2C[C@@H](O)[C@H](OC2=CC=1O)C1C=C(C(=CC=1)O)O
MCULE-4522193885 0.62 C1(O)C=C2O[C@@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-2332156212 0.62 CC(C1=C(OCCOC(C2OC3=C(C=CC=C3)C2)=O)C=CC=C1)=O
MCULE-3693742958 0.62 C1(O)=C(CCC)C(OCCCCC#N)=CC=C1C(C)=O
MCULE-6382811837 0.62 O1[C@H]([C@H](O)CC2C(=CC(OC)=CC1=2)OC)C1C=CC(=C(OC)C=1)OC
MCULE-9544199770 0.62 C1(C=CC=CC=1OCC(O)CNC(C)(C)C)C(CCC1=CC=CC=C1)=O.Cl
MCULE-6484075620 0.62 C1(C(CCC2C=CC(=C(OC)C=2)OC)=O)C(OC)=CC(=CC=1O)OC
MCULE-2007627155 0.62 C1(C(=O)CCC)=C(O)C(CC2C(O)=C(C(=O)CCC)C(OC)=C(C)C=2O)=C(O)C(C)=C1OC
MCULE-8843957588 0.62 C1=C(OC)C=CC(=C1OC)C(CC(C)CC(=O)O)=O
MCULE-9701066115 0.62 C1(C(CCC)=O)C(O)=C(CC2C(O)=C(CC3C(O)=C(C(=O)CCC)C(OC)=C(C)C=3O)C(O)=C(C(C(C)CC)=O)C=2O)C(O)=C(C)C=1OC
MCULE-2246746747 0.62 CC[C@@H](C(C1C(O)=C(CC2C(O)=C(C(CCC)=O)C(OC)=C(C)C=2O)C(O)=C(CC2C(O)=C(C(CCC)=O)C(OC)=C(C)C=2O)C=1O)=O)C
MCULE-7956279088 0.62 C1(C(CCCC(O)=O)=O)C=CC(=CC=1OC)OC
MCULE-7394717647 0.62 CC(C=O)CC1C=C2CCCOC2=CC=1
MCULE-1890534157 0.62 O=CCCC1=CC2=C(OCCC2)C=C1
MCULE-1449412458 0.62 CC1(OC2=C(C=CC(=C2)O)CC1)C
MCULE-4642760159 0.62 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1=CC(OC)=C(C(OC)=C1)O)=O
MCULE-2739140364 0.62 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC2=C(OCO2)C=1)=O
MCULE-9499751546 0.62 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1)O)=O
MCULE-8659119229 0.62 C1C(O)=C2C(=O)[C@@H](C3C(O)=C(C/C=C(\C)/C)C(O)=CC=3)COC2=C(C/C=C(\C)/C)C=1O
MCULE-4102972705 0.62 C12C3C=CC=CC=3C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MCULE-4640734168 0.62 CN1N=CC(CCOC2=CC3=C(C(CC(O3)(C)C)=O)C=C2)=C1
MCULE-8390027311 0.62 C12=CC(=CC=C1OC(CC2=O)(C)C)OCC(OCC)=O
MCULE-9154486801 0.62 C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1=CC=CC=C1
MCULE-8434839037 0.62 FC1C=C2C(=O)CC3(COC3)OC2=CC=1
MCULE-3220376293 0.62 C1(OCC2C=CC=CC=2)C=C(OC)C=CC=1CC(OC)C(O)C1=CC=CC=C1
MCULE-5566800939 0.62 C1(=CC(=CC=C1OC)CC1COC2C(=CC=CC=2)C1)C(N)=O
MCULE-9994849109 0.62 CCCCCCCCCCCCCCCCCCOC1=C(C(CC(OCC)=O)=O)C=CC=C1
MCULE-4558837172 0.62 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/CC/C=C(\C)/C
MCULE-9375899719 0.62 C1(C(CCCC(OC)=O)=O)C=CC(=CC=1OC)OC
MCULE-8546336326 0.62 OC1C=CC2=C(C=1)OC(CC(O)=O)C2
MCULE-6181398152 0.62 C(=O)(C1C=CC2OCCCC=2C=1)C
MCULE-4768488219 0.62 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCC(CC1)CC1=CC=CC=C1
MCULE-4973530486 0.62 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N(C)CCC#N
MCULE-4557119134 0.62 C1C(O)=C2C(=O)CC3(CCNCC3)OC2=CC=1
MCULE-1651216901 0.62 C1(=O)CC(C2=CC=C(C=C2)OC)OC2C=C(C)C=C(C)C1=2
MCULE-7797086388 0.62 O1C2C=CC=CC=2C(CC1C1C=CC(=C(OC)C=1)OC)=O
MCULE-9547618317 0.62 C1(C=CC(=CC=1OC)OC)C(=O)CC(=O)C(OCC)=O
MCULE-4146673230 0.62 O=C1C2C(=CC=CC=2OC(C)(C)C1)N
MCULE-1826158709 0.62 O=C(CCC1C(O)=CC(O)=C(C(CCC2C(OC)=CC(O)=CC=2)C2C=CC(O)=CC=2)C=1)C1C=CC(O)=CC=1
MCULE-4440171558 0.62 C12=C(C=CC3=CC(Br)=CC=C13)OCCC2=O
MCULE-8985736835 0.62 C1=C(CC(=O)O)C=CC2OC(C)(C)CCC=21
MCULE-9381697452 0.62 C1OC2=C(C(C)=CC=C2)C(=O)C1
MCULE-4211268789 0.62 C(=O)(CC(OCC)=O)C1=C(C=CC=C1OC)OC
MCULE-5152971296 0.62 C1(C=CC2=C(CCO2)C=1)C(CCC1C=CC=CC=1)=O
MCULE-9123960172 0.62 OC1=CC(O)=C(C(COC(C2CC3=C(C=CC(=C3)Cl)OC2)=O)=O)C=C1
MCULE-3558127928 0.62 C1(=CC=C(O)C=C1O)C(CCC1=CC=C(C=C1)OC)=O
MCULE-8689787289 0.62 O1CCCC(=O)C2=CC(F)=C(O)C=C12
MCULE-7044126112 0.62 [C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OS(=O)(=O)C)C1C=CC(OC)=CC=1
MCULE-7268905540 0.62 C12=C(C)C=C(C=C1C(CC(C1=CC=C(C(OC)=C1)OC)O2)=O)C
MCULE-8380949754 0.62 C1(COC2C(=CC=CC=2)C1)C(O)=O
MCULE-4134626562 0.62 C1(C=CC(=CC=1OC)OC)C(=O)CC(C)CC(C)(C)C
MCULE-4082761832 0.62 C1(C=CC(=CC=1OC)OC)C(C(CCCC)CC)=O
MCULE-8167286961 0.62 C1C(OC)=C(C(=O)CCCCC)C=CC=1OC
MCULE-6180090499 0.62 C1(C(CC)=O)=CC=C(C=C1O)OC1CCCCC1
MCULE-7338995727 0.62 C1(C(CCCCCCC)=O)=CC=C(C=C1OC)OC
MCULE-3116379112 0.62 C1(C(CCCCCCC(=O)C2=CC=C(C=C2OC)OC)=O)=CC=C(C=C1OC)OC
MCULE-7951250768 0.62 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1OC)OC
MCULE-2662973440 0.62 C1C=C(OCCCCCCCCCCCC)C=C(O)C=1C(=O)CC
MCULE-3053313454 0.62 C1C=C(OCCCCCCCCCC)C=C(O)C=1C(=O)CC
MCULE-8782646633 0.62 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O
MCULE-5785195808 0.62 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1)OC)=O
MCULE-8162303332 0.62 C1(O)C(C[C@H](C(=C)C)C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1C/C=C(/C)\C
MCULE-1311194604 0.62 O(C1=CC=CC=C1C(CCC1=CC=CC=C1)=O)C[C@@H](CNCCC)O
MCULE-8776872379 0.62 CCCNCC(COC1=C(C(CCC2=CC=CC=C2)=O)C=CC=C1)O
MCULE-5784719364 0.62 O1[C@H](CCC2C=CC(O)=CC1=2)C(OCC)=O
MCULE-5298308262 0.62 C[C@]1(OC2C=C(O)C=CC=2CC1)C(=O)OCC
MCULE-7799969597 0.62 C(=O)(C(C1C=CC=CC=1)C(C)=O)C1=CC=C(C=C1OC(C)=O)OC(C)=O
MCULE-6098726179 0.62 C1(=CC=C2OC(C(O)(C)C)C(O)C2=C1)C(C)=O
MCULE-6777649457 0.62 C12C=C(C)C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MCULE-1804642731 0.62 CC(C1=CC2=C(C=CC=C2)C=C1)NC(COC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)=O
MCULE-3316368164 0.62 C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCO2)=C1
MCULE-9879633213 0.62 C12=C(CCC(=O)O1)C=C1C(OC(CC1)=O)=C2
MCULE-6816758919 0.62 C(O)(=O)C[C@H]1C2=CC=C(O)C=C2OC1
MCULE-7702815747 0.62 C1(C=CC(=CC=1OC)OC)C(=O)C(C)(C)OC(C)=O
MCULE-9544003725 0.62 O1C(COC)CC2=CC(C=O)=CC=C21
MCULE-4399831429 0.62 OC(CC1C2=C(C=C(C=C2)O)OC1)=O
MCULE-8425993159 0.62 O=C1CCC2=C1C(OC)=CC(OC)=C2
MCULE-7707382821 0.62 C12=CC(C)=CC=C1OC(CC2=O)C1C=CC(=CC=1)Cl
MCULE-3426201479 0.62 C12C=C(C=CC(=O)C=1C=CC=C2[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1)[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1
MCULE-7688686969 0.62 C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](OC)C2=CC=1
MCULE-9557247198 0.62 C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@H](OC)C2=CC=1
MCULE-4836635561 0.62 C1(=CC=C(C=C1O)OC)C(=O)CC(C1C=CC=CC=1)=O
MCULE-5335379027 0.62 C12CCCOC1=CC=C(CCC(O)=O)C=2
MCULE-7602610292 0.62 C12C=C(F)C=CC=1OC(CC2=O)C
MCULE-1994873281 0.62 COC1=C2C(C(CC(O2)(C)C)=O)=CC=C1
MCULE-4433136405 0.62 C(=O)(C1=CC=C(OCCCO)C(CCC)=C1O)C
MCULE-3033350630 0.62 C1(O)C=C2OC[C@@H](C3C(O)=CC(OC)=CC=3)CC2=CC=1
MCULE-6861091708 0.62 C1OC2=C(C=CC(C)=C2)C(=O)C1
MCULE-4742880627 0.62 O=C1C2C=C(C=CC=2OCC1)O
MCULE-2005135425 0.62 C1C=C2CC(C3C(O)=CC(OC)=CC=3)COC2=CC=1O
MCULE-1961293268 0.62 C1(C=CC(=CC=1OCC)OCC)C(=O)C(C)=O
MCULE-6050206432 0.62 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1=CC=C(C=C1)OC(C)C)=O
MCULE-9540714374 0.62 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=CC=1)O)=O
MCULE-7335535921 0.62 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1=CC=CC=C1)=O
MCULE-8883369797 0.62 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC=C(C=C1)O)=O
MCULE-6203713575 0.62 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=CC=1)OC)=O
MCULE-8466615069 0.62 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC=C(C=C1)OC)=O
MCULE-2703852083 0.62 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(NCCCOC(C)C)=O
MCULE-6844411000 0.62 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N(C)CC(=O)N(C)C
MCULE-4322456236 0.62 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCCC1=CC=CC=C1OC)=O
MCULE-4894129765 0.62 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC1CCCCC1
MCULE-4524666852 0.62 C12=CC(=CC=C1OC1(CCCCC1)CC2=O)OCC(O)=O
MolPort-009-412-760 0.62 OC1=CC=C(C(=O)COC(=O)C2COC3=CC=C(Cl)C=C3C2)C(O)=C1
MolPort-002-894-177 0.62 COC1=CC=C(C=C1)[C@@H]1OC2=CC=CC=C2C(=O)[C@H]1OS(C)(=O)=O
MolPort-028-617-866 0.62 OC(=O)[C@@H]1COC2=CC=CC=C2C1
MolPort-000-674-952 0.62 COC1=C(OC)C=C(C=C1)C1CC(=O)C2=C(O1)C(C)=CC(C)=C2
MolPort-000-142-762 0.62 OC(=O)C1COC2=CC=CC=C2C1
MolPort-035-873-601 0.62 COC1=C(OC)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-005-945-432 0.62 CC(=O)C1=CC2=C(OC(C2O)C(C)(C)O)C=C1
MolPort-000-651-424 0.62 CC(=O)OC1=CC(OC(C)=O)=C(C=C1)C(=O)C(C(C)=O)C1=CC=CC=C1
MolPort-002-545-323 0.62 CCCNCC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-039-338-750 0.62 CC(C)=CC[C@H](CC1=C2O[C@@H](CC(=O)C2=C(O)C(CC=C(C)C)=C1O)C1=C(O)C=C(O)C=C1)C(C)=C
MolPort-005-945-133 0.62 COC1=CC(O)=C(C(=O)CCC2=CC=C(O)C=C2)C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C1
MolPort-035-873-176 0.62 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-020-068-388 0.62 CC(NC(=O)COC1=CC=C2C(=O)CC(C)(C)OC2=C1)C1=CC2=CC=CC=C2C=C1
MolPort-023-330-362 0.62 OC(=O)CC1COC2=C1C=CC(O)=C2
MolPort-046-592-304 0.62 OC(=O)C[C@@H]1COC2=CC(O)=CC=C12
MolPort-002-136-809 0.62 O=C1CCC2=CC3=C(OC(=O)CC3)C=C2O1
MolPort-044-854-720 0.62 O=C1C[C@@H]2[C@H]1COC1=C2C=CC=C1
MolPort-000-659-529 0.62 CC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCO3)C=C2)C=C1
MolPort-002-509-154 0.62 CC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC2=C(OCCO2)C=C1
MolPort-001-814-284 0.62 COC1=CC2=C(C(=O)CC2)C(OC)=C1
MolPort-003-792-965 0.62 CC1=CC2=C(OC(CC2=O)C2=CC=C(Cl)C=C2)C=C1
MolPort-000-136-720 0.62 OC(=O)CCC1=CC2=C(OCCC2)C=C1
MolPort-044-754-167 0.62 CO[C@@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC1=CC(O)=C(O)C=C1
MolPort-006-827-853 0.62 COC1=CC(O)=C(C=C1)C(=O)CC(=O)C1=CC=CC=C1
MolPort-039-052-647 0.62 CO[C@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC1=CC(O)=C(O)C=C1
MolPort-021-482-677 0.62 COC1=CC=CC2=C1OC(C)(C)CC2=O
MolPort-000-157-924 0.62 COC(=O)CC(=O)C1=CC=C(OC)C(OC)=C1OC
MolPort-000-155-703 0.62 CC1CC(=O)C2=C(O1)C=CC(F)=C2
MolPort-020-943-298 0.62 CC1(C)CC(=O)C2=CC(F)=CC=C2O1
MolPort-039-057-275 0.62 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-000-847-576 0.62 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CCCCC1)C=C2O
MolPort-001-763-617 0.62 CC1=CC2=C(C=C1)C(=O)CCO2
MolPort-001-740-584 0.62 COC1=CC=C(C2COC3=CC(O)=CC=C3C2)C(O)=C1
MolPort-006-806-200 0.62 COC1=C(CCNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=CC=C1
MolPort-002-265-320 0.62 CCOC1=CC(OCC)=C(C=C1)C(=O)C(C)=O
MolPort-035-701-775 0.62 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-000-857-875 0.62 CN(C)C(=O)CN(C)C(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-002-668-343 0.62 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CCCCCCC1)C=C2O
MolPort-035-701-577 0.62 CC(=O)C1=CC=C2OC(=O)CC(C3=CC=C(O)C=C3)C2=C1O
MolPort-035-700-909 0.62 CC(=O)C1=CC=C2OC(=O)CC(C3=CC=CC=C3)C2=C1O
MolPort-039-056-352 0.62 OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-003-803-117 0.62 OC1=CC2=C(OCCC2=O)C=C1
MolPort-000-847-482 0.62 CC(C)OCCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-039-338-174 0.62 COC1=CC=C([C@@H]2COC3=CC(O)=CC=C3C2)C(O)=C1
MolPort-035-700-895 0.62 CC(C)OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-044-193-699 0.62 CC1OC(OC2C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(O)C(O)C1O
MolPort-046-689-931 0.62 COC1=C(OC(C)=O)C=C(C=C1)[C@@H]1CC(=O)C2=C(OC(C)=O)C=C(OC(C)=O)C=C2O1
MolPort-001-776-670 0.62 OC(=O)C1CC(=O)C2=C(O1)C=CC(F)=C2
MolPort-039-057-742 0.62 OC1=C2C(CC(=O)OC2=CC=C1C(=O)C1=CC=CC=C1)C1=CC=C(OCCC2=CC=C3OCCC3=C2)C=C1
MolPort-046-689-930 0.62 COC1=C(OC(C)=O)C=C(C=C1)C1CC(=O)C2=C(OC(C)=O)C=C(O)C=C2O1
MolPort-006-821-805 0.62 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O)C=C2O
MolPort-022-377-685 0.62 OC(=O)C1=CC=C2OCCC(=O)C2=C1
MolPort-006-067-361 0.62 OC(=O)COC1=CC2=C(OC3(CCCCC3)CC2=O)C=C1
MolPort-001-740-538 0.62 C[C@@H]1O[C@@H](O[C@@H]2[C@H](OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C=C2)[C@H](O)[C@H](O)[C@H]1O
MolPort-002-903-716 0.62 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC(Cl)=C2
MolPort-006-327-481 0.61 OC1=CC2=C(OC3(CCCCC3)CC2=O)C=C1
MolPort-020-163-530 0.61 CN(C)S(=O)(=O)CCCOC1=CC=C2C(=O)CC(C)(C)OC2=C1
MolPort-002-915-228 0.61 CC1(C)CC(=O)C2=CC=C(OCC3=CC=C(C=C3)[N+]([O-])=O)C=C2O1
MolPort-002-499-670 0.61 CCC1(C)CC(=O)C2=CC(N)=CC=C2O1
MolPort-007-673-710 0.61 OC1=CC2=C(OC3(CC2=O)CCCCCC3)C=C1
MolPort-007-673-742 0.61 CC1CCC2(CC1)CC(=O)C1=C(O2)C=CC(O)=C1
MolPort-008-318-714 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CC3=CC=CC=C3C1)C=C2O
MolPort-008-313-834 0.61 O=C(COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2)N1CCOCC1
MolPort-013-264-378 0.61 O=C1CCOC2=C1C=C1OCOC1=C2
MolPort-005-248-484 0.61 CCOC(=O)CC(=O)C1=C(OCC)C=CC=C1
MolPort-019-937-421 0.61 COC1=CC(OC)=C2C(=O)C[C@H](OC2=C1\C=C\C(C)(C)O)C1=CC=CC=C1
MolPort-000-640-497 0.61 CCCCCCC1=CC=C(OCC(O)=O)C=C1OCC(O)=O
MolPort-000-145-734 0.61 OC(=O)C1CCC2=C(O1)C=CC=C2
MolPort-035-706-114 0.61 CC(C)C[C@H]1[C@@H](C(C)C)[C@@H](OC2=C(C=O)C(O)=C(C=O)C(O)=C12)C1=C(O)C(C=O)=C(O)C(C=O)=C1O
MolPort-003-946-379 0.61 CCCC1=C(OCCCOC2=CC=C(OCC(O)=O)C=C2)C=CC(C(C)=O)=C1O
MolPort-000-736-201 0.61 COC1=C(OC)C=C2C3C(COC2=C1)OC1=C(C=CC2=C1CC(O2)C(=C)CO)C3=O
MolPort-046-690-833 0.61 Cl.[2H]C([2H])(NCCC)C([2H])(O)C([2H])([2H])OC1=CC=CC=C1C(=O)CCC1=CC=CC=C1
MolPort-046-418-559 0.61 Cl.[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])NCC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-008-609-323 0.61 CCCC(=O)C1=C(OCC)C=CC=C1
MolPort-002-466-425 0.61 CCCOC1=CC(OCCC)=C(C=C1)C(C)=O
MolPort-027-356-099 0.61 CCCC(=O)C1=CC=CC=C1OC(C)C
MolPort-023-340-285 0.61 CC(C)CC(=O)C1=CC=CC=C1OC(C)C
MolPort-002-071-461 0.61 COC1=CC2=C(C=C1)C(=O)CC1(CCN(CC3=CC=CC=C3)CC1)O2
MolPort-022-373-452 0.61 CC1(C)CCC2=C(O1)C=CC=C2O
MolPort-003-666-514 0.61 Cl.CCCNCC(O)COC1=C(C=CC=C1)C(=O)CCC1=CC=CC=C1
MolPort-002-515-316 0.61 COC1=C(OC)C=C2[C@H]3[C@@H](COC2=C1)OC1=C(C=CC2=C1C[C@@H](O2)C(=C)CO)C3=O
MolPort-028-950-743 0.61 OC(=O)C1CC2=C(O1)C=C(OC(F)F)C=C2
MolPort-002-472-238 0.61 OC(=O)C1COC2=C(C1)C1=CC=CC=C1C=C2
MolPort-002-994-713 0.61 COC1=CC(OCC(O)=O)=C(C=C1)C(C)=O
MolPort-001-741-320 0.61 COC1=CC(=CC=C1O)C1CC(=O)C2=C(O)C(CC=C(C)C)=C(O)C=C2O1
MolPort-046-765-874 0.61 OC1=CC=C(C=C1)C1COC2=CC(O)=CC(O)=C2C1
MolPort-046-195-068 0.61 COC(=O)C[C@H]1COC2=CC(O)=CC=C12
MolPort-027-836-501 0.61 COC(=O)C[C@@H]1COC2=CC(O)=CC=C12
MolPort-002-834-808 0.61 O[C@@H]1CC2=C(O[C@H]1C1=CC=CC=C1)C=CC=C2
MolPort-044-217-113 0.61 OC1C(OC2=C(C=CC(Br)=C2)C1=O)C1=CC=C(C=C1)[N+]([O-])=O
MolPort-008-645-060 0.61 CC1=CC=C(C)C2=C1OCCC2=O
MolPort-020-233-866 0.61 COC(=O)CC1COC2=C1C=CC(O)=C2
MolPort-006-728-030 0.61 BrC1=CC2=C(C=C1)C(=O)CCO2
MolPort-029-020-315 0.61 CC1(C)CC(=O)C2=C(O1)C(N)=CC=C2
MolPort-044-564-106 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1C3CC4CC(C3)CC1C4)C=C2O
MolPort-002-663-777 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CCCCCC1)C=C2O
MolPort-002-666-727 0.61 CC1CCCCC1NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-046-508-979 0.61 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C[C@H]1OC(=O)C1=CC(O)=C(O)C(O)=C1
MolPort-001-740-171 0.61 OC[C@H]1O[C@@H](OC2=C3C(OC(O)(CC4=CC=C(O)C=C4)C3=O)=CC(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-002-534-867 0.61 CC(=O)NC1=CC=C(NC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-035-699-830 0.61 COC1=CC=C(C2CC(=O)OC3=CC=C(C(C)=O)C(O)=C23)C2=CC=CC=C12
MolPort-005-945-131 0.61 COC1=CC=C(CCC(=O)C2=C(O)C=C(O)C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1
MolPort-001-742-470 0.61 COC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
MolPort-046-596-314 0.61 COC1=CC2=C(O[C@@H](CC2=O)C2=CC=CC=C2)C=C1
MolPort-009-013-746 0.61 O=CC1=C2OCCCC2=CC=C1
MolPort-022-938-725 0.61 CCCCOC1=CC=C(C=C1)C(=O)CC(=O)OC
MolPort-035-706-272 0.61 CC1(C)C[C@H]2[C@H]1CC[C@@]1(C)OC3=C([C@@H]([C@@H]1CCC2=C)C1=CC=CC=C1)C(O)=C(C=O)C(O)=C3C=O
MolPort-035-706-213 0.61 CC1(C)C[C@H]2[C@H]1CC[C@@]1(C)OC3=C([C@H]([C@@H]1CCC2=C)C1=CC=CC=C1)C(O)=C(C=O)C(O)=C3C=O
MolPort-004-418-266 0.61 CCC(=O)C1=CC=CC=C1OCCCCOC1=CC=CC=C1C(=O)CC
MolPort-039-141-904 0.61 CC1(C)C[C@H]2[C@H]1CC[C@]1(C)OC3=C(C=O)C(O)=C(C=O)C(O)=C3[C@@H]([C@H]1CCC2=C)C1=CC=CC=C1
MolPort-012-675-260 0.61 COC(=O)C(C)(O)CC1=C(OC)C=CC=C1
MCULE-2872239229 0.61 C12=C(O)C=C(C=C1OC1(CC2=O)CCN(CC1)C(C)=O)O
MCULE-1761059072 0.61 CN(S(CCCOC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)(=O)=O)C
MCULE-8141390165 0.61 C12=CC(O)=CC=C1OC1(CC2=O)CCCCC1
MCULE-5298931563 0.61 O=C1C2C(=CC=CC=2OC(C)(C)C1)Br
MCULE-4049182556 0.61 C12=CC(O)=CC=C1OC1(CC2=O)CCC(CC1)C
MCULE-2739952519 0.61 C12=CC(O)=CC=C1OC1(CC2=O)CCCCCC1
MCULE-3915769487 0.61 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(=O)N1CCOCC1
MCULE-5812132513 0.61 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)NC1CC2=C(C=CC=C2)C1
MCULE-6797907085 0.61 O1CCCC(=O)C2=CC=C(O)C(F)=C12
MCULE-1362087997 0.61 O=C1C2=C(C=C3C(=C2)OCO3)OCC1
MCULE-6342612789 0.61 O1CCCC(=O)C2=CC=C(O)C(Cl)=C12
MCULE-9397448546 0.61 C(=O)(CC(OCC)=O)C1C=CC=CC=1OC(C)C
MCULE-3148354740 0.61 C1(C(CCCCCC)=CC=C(OCC(O)=O)C=1)OCC(O)=O
MCULE-5579568884 0.61 C1C=C2C(OC(C(=O)O)CC2)=CC=1
MCULE-8385184047 0.61 CCOC(CC(C1=C(OCC)C=CC=C1)=O)=O
MCULE-8605141998 0.61 C1(OC)C(/C=C/C(O)(C)C)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-4541279484 0.61 C1(C(=C2C([C@@H](CC(C)C)[C@@H](C(C)C)[C@H](C3C(O)=C(C=O)C(O)=C(C=O)C=3O)O2)=C(C=1C=O)O)C=O)O
MCULE-2488959319 0.61 O=C(COC1C=CC(OCCCOC2C(CCC)=C(O)C(C(=O)C)=CC=2)=CC=1)O
MCULE-4586328868 0.61 C1(C=CC=CC=1OC(C)C)C(C(CC)CC)=O
MCULE-5869691851 0.61 C1(C)=CC(C)=CC(CCC(=O)C2C(OC)=CC=CC=2)=C1
MCULE-2047175817 0.61 C1(C=CC=CC=1OC(C)C)C(=O)C(C)(C)CC
MCULE-2566814696 0.61 C1(C=CC=CC=1OC(C)C)C(C(C)CC)=O
MCULE-3480578044 0.61 CC1(OC2=C(C(=CC=C2)O)CC1)C
MCULE-1391687252 0.61 C1(C=CC=CC=1OC(C)C)C(CCC)=O
MCULE-5228477044 0.61 C(=O)(CC(C)(C)C)C1C=CC=CC=1OC(C)C
MCULE-5407284716 0.61 C(=O)(CC(C)C)C1C=CC=CC=1OC(C)C
MCULE-4057631490 0.61 C1(C=CC=CC=1OCC)C(CCC)=O
MCULE-1664617977 0.61 COC1=CC=C2C(OC3(CC2=O)CCN(CC2=CC=CC=C2)CC3)=C1
MCULE-5412176192 0.61 C1=CC=CC(CCC(=O)C2C=CC(OC)=CC=2)=C1OC
MCULE-8674401328 0.61 C1(C)=CC=CC(CCC(=O)C2C(OC)=CC=CC=2)=C1
MCULE-7195960889 0.61 CCCOC1=CC(OCCC)=C(C(C)=O)C=C1
MCULE-2118521539 0.61 C12OC3COC4=C(C=C(C(OC)=C4)OC)C3C(=O)C=1C=CC1=C2CC(O1)C(CO)=C
MCULE-6377337101 0.61 C12O[C@]3([H])COC4=C(C=C(C(OC)=C4)OC)[C@@]3(C(=O)C=1C=CC1=C2C[C@](O1)([H])C(CO)=C)[H]
MCULE-1073485790 0.61 OC(C1OC2=C(C=CC(=C2)OC(F)F)C1)=O
MCULE-2503553157 0.61 O(C1=CC=CC=C1C(CCC1=CC=CC=C1)=O)C[C@@H](CNCCC)O.Cl
MCULE-5193630487 0.61 Cl.CCCNCC(COC1=C(C(CCC2=CC=CC=C2)=O)C=CC=C1)O
MCULE-2163904316 0.61 C1(O)C=C2C(C(CC(C3=CC(OC)=C(O)C=C3)O2)=O)=C(C=1C/C=C(\C)/C)O
MCULE-1323723298 0.61 C12=C(C=CC3=CC=CC=C13)OCC(C(O)=O)C2
MCULE-5903514301 0.61 C1(C=CC(=CC=1OC)OC)C(C1CCCCC1)=O
MCULE-7106017265 0.61 C1OC2=C(C=CC=C2C)CC1C(O)=O
MCULE-9193236782 0.61 C1(C=C(C)C=CC=1OC)C(=O)CC(OC)=O
MCULE-9552288738 0.61 C1(CC1C(O)=O)C1C(OC)=CC(=CC=1OC)OC
MCULE-8402625536 0.61 C1(C=CC(=CC=1OC)OC)C(=O)C(CC)C1C=CC=CC=1
MCULE-6077014012 0.61 C1(C=CC(=CC=1OC)OC)C(CCC1CCCC1)=O
MCULE-2647008310 0.61 C1(C2C=CC(=CC=2OC)OC)CC1C(O)=O
MCULE-4955494911 0.61 C1(C=CC(=CC=1OC)OC)C(C1CCCC1)=O
MCULE-1127619913 0.61 C1=CC(OC)=CC(OCC(=O)O)=C1C(=O)C
MCULE-8923886978 0.61 C(C(OC)=O)C(=O)C1C=CC2=C(CCO2)C=1
MCULE-3458953916 0.61 O1C2C=CC=CC=2C[C@@H](O)[C@@H]1C1C=CC=CC=1
MCULE-6294056153 0.61 C12=CC(O)=CC=C1C(CO2)CC(OC)=O
MCULE-1627850477 0.61 C(OC)(=O)C[C@@H]1C2=CC=C(O)C=C2OC1
MCULE-6000291859 0.61 C(OC)(=O)C[C@H]1C2=CC=C(O)C=C2OC1
MCULE-6675312041 0.61 COC(CC1(COC2=C1C=CC(O)=C2)[H])=O
MCULE-8520515532 0.61 O=C(C[C@H]1C2C(=CC(=CC=2)O)OC1)OC
MCULE-6317665949 0.61 C12C=CC(=CC=1OCCC2=O)Br
MCULE-9649438176 0.61 CC1=C2C(C(CCO2)=O)=C(C)C=C1
MCULE-1913985953 0.61 O(C1=CC(O)=CC2OC(CC3C=CC(O)=CC=3)(O)C(=O)C1=2)[C@H]1[C@@H]([C@@H](O)[C@H](O)[C@H](O1)CO)O
MCULE-5482249185 0.61 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC1CCCCCC1
MCULE-8294611550 0.61 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC1C2CC3CC1CC(C3)C2
MCULE-6496599473 0.61 C1(=CC=C(C=C1OC(C)=O)OC(C)=O)C(C1CCCCC1)=O
MCULE-4382912006 0.61 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1
MCULE-4185097548 0.61 C1=C(C=C(O)C(C(=O)CCC2=CC=C(C=C2)OC)=C1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)O
MCULE-3625538935 0.61 C12C=C(OC)C=CC=1OC(CC2=O)C1=CC=CC=C1
MCULE-7439794905 0.61 C12C=C(OC)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MCULE-1092700241 0.61 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=C2C=CC=CC=12)OC)=O
MCULE-2942199725 0.61 CCC(C1=C(OCCCCOC2=C(C(CC)=O)C=CC=C2)C=CC=C1)=O
MCULE-4579213216 0.61 C(C(OC)=O)C(=O)C1C=CC(OCCCC)=CC=1
MCULE-4992092010 0.61 C1OC2=C(C=CC=C2C=O)CC1
MCULE-3748004782 0.61 C1(C(CCCCCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OC
MCULE-1722721331 0.61 C1=C(C=CC(C(=O)CCCCCC(=O)OCC)=C1OC)OC
MCULE-1327294977 0.61 C1=C(C=CC(C(=O)CCCCCCC(=O)OCC)=C1OC)OC
MCULE-5301896706 0.61 C1=C(OC)C=CC(C(=O)CCCCC(=O)OCC)=C1OC
MCULE-9979782762 0.61 C1(O)C=C2O[C@H](C3C=CC(O)=C(C4C5O[C@H](C6C=CC(O)=CC=6)CC(=O)C=5C(O)=CC=4O)C=3)CC(=O)C2=C(O)C=1
MCULE-1581949977 0.61 C1(=CC=C(C=C1OCC(OC)=O)OCC(OC)=O)C(=O)COC1=CC=C(C=C1)C1C=CC=CC=1
MCULE-5696093381 0.61 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-6278227619 0.61 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(Cl)C=1)O)=O
MCULE-2286825236 0.61 C1(=CC=C(C=C1OCC(OCCCC)=O)OCC(OCCCC)=O)C(=O)COC1C=CC(=CC=1)C1=CC=CC=C1
MCULE-8760789087 0.61 COC1=CC(=C(C(CO)=O)C(OC)=C1)O
MCULE-2830881186 0.61 C1(=CC(=C2C(OC(C3=CC=C(O)C=C3)CC2=O)=C1)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MCULE-2814428222 0.61 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3743116895 0.61 C12C=C(C=C(O)C=1C(=O)C[C@@H](C1=CC=C(O)C=C1)O2)O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O
MCULE-4853708291 0.61 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1
MCULE-9221277712 0.61 C1OC2=CC(OC)=CC=C2CC1
MCULE-8744806299 0.61 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=C(OC)C2=C(OCCO2)C=1)=O
MCULE-5229560297 0.61 O[C@H]1[C@H](C2C3O[C@@H]([C@H](CC=3C(O)=CC=2O)O)C2C=C(O)C(O)=CC=2)C2C(=CC(=CC=2O[C@@H]1C1C=C(O)C(O)=CC=1)O)O
MCULE-2360599707 0.61 O[C@H]1[C@H](C2=C(O)C=C(O)C3=C2O[C@H](C2C=CC(O)=C(O)C=2)[C@@H](C3)O)C2C(=CC(=CC=2O)O)O[C@@H]1C1C=CC(O)=C(O)C=1
MCULE-4879610005 0.61 C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1
MCULE-7364169831 0.61 C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1
MCULE-8445748059 0.61 C1(C=CC(OCCCCC)=CC=1)C(=O)CC(=O)OC
MCULE-5997966829 0.61 C1(C(=O)CC(=O)OC)C=CC(OCCOC2C=CC=CC=2)=CC=1
MCULE-4391473989 0.61 C1(C(CCCCCCC)=O)C=CC(=CC=1O)OCC
MCULE-2193290964 0.61 C12C(=CC(=CC=1O[C@]([C@@]([H])(O)C2=O)([H])C1=CC=C(C=C1)O)C)OC1OC(CO)C(C(O)C1O)O
MCULE-8250292277 0.61 C12C(=O)CC(C)(C)OC1=CC(=CC=2)OCC(=O)NC1=CC=CC=C1
MCULE-9480249121 0.61 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCO2)C=1
MCULE-9623040665 0.61 [Na+].[Na+].C1(C(CCCCCC)=CC=C(OCC(=O)[O-])C=1)OCC(=O)[O-]
MCULE-2623436741 0.61 COC1=CC(OCC(COC2=C(C(C3=CC=CC=C3)=O)C=CC(OC)=C2)O)=C(C(C2=CC=CC=C2)=O)C=C1
MCULE-1443633289 0.61 COC1=C(CCC(OC2=CC=C(C(C3=CC=CC=C3)=O)C=C2)=O)C=CC=C1
MCULE-9691100622 0.61 C1C2=C(OC)C=C(C(C(=O)O)=C2OC1C(C)(C)O)CCC1=CC=CC=C1
MCULE-8370451498 0.61 C(C(OCC)=O)(C(OCC)=O)CC1=CC(=CC=C1OC(C)C)C(C)=O
MCULE-8857765579 0.61 C(C(OCC)=O)(C(OCC)=O)CC1C(OCC)=CC=C(C(C)=O)C=1
MCULE-9149264714 0.61 C1(C)(CC(C)(C)OC2C=C(OC(C)=O)C=CC1=2)C1C=CC(=CC=1OC(C)=O)OC(C)=O
MCULE-9998095829 0.61 CC1=C(C)C=C2C(OCCCC2=O)=C1
MCULE-8848508522 0.61 CC1C2=C(C=CC(OCCOC3=C(C(C)=O)C=CC=C3)=C2C(=O)C1)C
MCULE-3002316905 0.61 C1=C2O[C@@H](C(=C)C)CC2=C2O[C@]3([H])C(O)OC4C=C(OC)C(OC)=CC=4[C@]3([H])C(C2=C1)=O
MCULE-5951779990 0.61 C1(=CC=C(C=C1OCC(OCCCCC)=O)OCC(OCCCCC)=O)C(=O)COC1=CC=C(C=C1)C1C=CC=CC=1
MCULE-6715153088 0.61 C12C=C(O)C=CC=1C(CC1(CCN(CC1)C(C)=O)O2)=O
MCULE-7747662813 0.61 C1C=C2C(OC(CO)CC2)=CC=1
MCULE-7078100837 0.61 C(=O)(C1CC1)C1C=CC=CC=1OC(C)C
MCULE-1160252875 0.61 C(CC)(C1C(OC)=C(C)C(OC)=CC=1)=O
MCULE-8294927471 0.61 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCC(CC1)C(N)=O
MCULE-8801234697 0.61 CN1N=C(COC2=CC3=C(C(CC4(O3)CCCCC4)=O)C=C2)N=N1
MCULE-4667867343 0.61 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)NCC(NCCOC)=O
MCULE-5715854332 0.61 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NCC(C1=CC=CC=C1)C1C=CC=CC=1
MCULE-9480304541 0.61 C1(O)C=C2OC[C@@H](C3C(O)=CC(O)=CC=3)CC2=CC=1
MCULE-4623022959 0.61 COC(C1CC2=C(C=CC=C2)OC1)=O
MCULE-2839673992 0.61 C1(C(CCC=C)=O)C=CC(=CC=1OC)OC
MCULE-3387577878 0.61 C1(O)=CC(C)=CC=C1C(=O)CC(=O)C1C=CC=CC=1OC(C)C
MCULE-4002824005 0.61 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2C(=CC=1)C(=O)C[C@H](O2)C1=CC=CC=C1
MCULE-1244242860 0.61 C1(OC(=O)C)C=C2OCC(C3C=CC(OC(=O)C)=CC=3)CC2=CC=1
MCULE-5081594902 0.61 O1C2=CC=C(C=C2CC1C(O)=O)CC
MCULE-5023548153 0.61 C1(=O)C2=CC=CC=C2OCC1(C)CCl
MCULE-1769245850 0.61 OC1C=CC(=CC=1)C1OC2C(=C(C=C(O)C=2)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(=O)C1
MCULE-4357514624 0.61 C(=O)(CC1C=CC(=CC=1)CC1COC2C(=CC=C(OC)C=2)C1)N(C)C
MCULE-1891817974 0.61 C1(C)(C)OC2=CC(C#N)=CC=C2C(=O)C1
MCULE-1153620605 0.61 OC(COC1=C2C(CCC2=O)=CC=C1)=O
MCULE-8422648269 0.61 C12=CC(OC)=CC=C1CC(CO2)CC1C=CC=C(C=1)OCC(N)=O
MCULE-8530944642 0.61 C12=CC(OC)=CC=C1CC(CO2)CC1C=CC(=CC=1)CC(NC)=O
MCULE-9287625468 0.61 C1(C)(C)OC2=C(C(F)=CC=C2)C(=O)C1
MCULE-6602566974 0.61 C12C(F)=CC=CC=1C(=O)CC(C)(C)O2
MCULE-3212694499 0.61 COC1=CC2=C(CC(C(OC3=CC=C(C(C(F)(F)F)(O)C)C=C3)=O)CO2)C=C1
MCULE-1088045767 0.61 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1=CC=C(C=C1)C(C)C)=O
MCULE-5895803515 0.61 C1(C2=CC=CC=C2O)CC(C2C=C(O)C=CC=2O1)=O
MCULE-7103803082 0.61 C12=CC(Cl)=CC=C1OCC(CC(O)=O)C2=O
MCULE-7509034065 0.61 O(C1=C2C(=CC(OC)=C1)O[C@H](C1C=CC(O)=C(OC)C=1)[C@@H](O)C2=O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MolPort-039-052-619 0.61 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C(=C(O)C=C2O)C1=C(O)C=CC(=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-002-536-031 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC(O)C1=CC=CC=C1)C=C2O
MolPort-035-873-377 0.61 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-006-069-106 0.61 OC[C@H]1O[C@@H](OC2=CC3=C(C(=O)C[C@H](O3)C3=CC=C(O)C=C3)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-001-740-528 0.61 OC[C@H]1O[C@@H](OC2=CC3=C(C(=O)CC(O3)C3=CC=C(O)C=C3)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-035-873-386 0.61 OC1=C(Cl)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-782-194 0.61 CCC(O)CC1=C(OC)C=C(OC)C=C1
MolPort-039-338-525 0.61 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2O1
MolPort-035-874-087 0.61 COC1=CC(=CC2=C1OCCO2)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-046-591-457 0.61 COC1=CC(OC)=C(C(=O)CO)C(O)=C1
MolPort-000-664-239 0.61 COC(=O)COC1=CC(OCC(=O)OC)=C(C=C1)C(=O)COC1=CC=C(C=C1)C1=CC=CC=C1
MolPort-002-048-858 0.61 CCCCOC(=O)COC1=CC(OCC(=O)OCCCC)=C(C=C1)C(=O)COC1=CC=C(C=C1)C1=CC=CC=C1
MolPort-039-338-091 0.61 O[C@@H]1CC2=C(O)C=C(O)C([C@@H]3[C@@H](O)[C@H](OC4=C(C5[C@@H](O)[C@H](OC6=CC(O)=CC(O)=C56)C5=CC=C(O)C(O)=C5)C(O)=CC(O)=C34)C3=CC=C(O)C(O)=C3)=C2O[C@@H]1C1=CC=C(O)C(O)=C1
MolPort-003-927-506 0.61 O[C@H]1CC2=C(O)C=C(O)C([C@@H]3[C@@H](O)[C@H](OC4=C3C(O)=CC(O)=C4)C3=CC(O)=C(O)C=C3)=C2O[C@@H]1C1=CC(O)=C(O)C=C1
MolPort-003-932-480 0.61 O[C@@H]1CC2=C(O)C=C(O)C([C@@H]3[C@@H](O)[C@H](OC4=C3C(O)=CC(O)=C4)C3=CC(O)=C(O)C=C3)=C2O[C@@H]1C1=CC(O)=C(O)C=C1
MolPort-003-959-148 0.61 O[C@H]1CC2=C(O)C=C(O)C([C@H]3[C@H](O)[C@H](OC4=C3C(O)=CC(O)=C4)C3=CC(O)=C(O)C=C3)=C2O[C@@H]1C1=CC(O)=C(O)C=C1
MolPort-002-129-907 0.61 CCCCCCCC(=O)C1=C(O)C=C(OCC)C=C1
MolPort-002-914-716 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1=CC=CC=C1)C=C2
MolPort-000-659-530 0.61 COC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCO3)C=C2)C=C1
MolPort-004-149-559 0.61 COC1=CC=CC=C1CCC(=O)OC1=CC=C(C=C1)C(=O)C1=CC=CC=C1
MolPort-006-668-492 0.61 COC1=CC(CCC2=CC=CC=C2)=C(C(O)=O)C2=C1CC(O2)C(C)(C)O
MolPort-005-837-159 0.61 COC1=CC=C(C(=O)C2=CC=CC=C2)C(OCC(O)COC2=CC(OC)=CC=C2C(=O)C2=CC=CC=C2)=C1
MolPort-002-368-929 0.61 [Na+].[Na+].CCCCCCC1=CC=C(OCC([O-])=O)C=C1OCC([O-])=O
MolPort-039-057-487 0.61 CC1=CC2=C(C(=O)[C@H](O)[C@H](O2)C2=CC=C(O)C=C2)C(OC2OC(CO)C(O)C(O)C2O)=C1
MolPort-002-300-434 0.61 CCOC(=O)C(CC1=CC(=CC=C1OCC)C(C)=O)C(=O)OCC
MolPort-001-927-639 0.61 CC(=O)OC1=CC(OC(C)=O)=C(C=C1)C1(C)CC(C)(C)OC2=C1C=CC(OC(C)=O)=C2
MolPort-013-264-354 0.61 CC1=CC2=C(C=C1C)C(=O)CCCO2
MolPort-002-048-861 0.61 CCCCCOC(=O)COC1=CC(OCC(=O)OCCCCC)=C(C=C1)C(=O)COC1=CC=C(C=C1)C1=CC=CC=C1
MolPort-031-467-605 0.61 BrC1=CC=C2OC3(CCC3)CC(=O)C2=C1
MolPort-009-425-547 0.61 CC1CC(=O)C2=C1C(C)=CC=C2OCCOC1=CC=CC=C1C(C)=O
MolPort-005-944-928 0.61 COC1=C(OC)C=C2[C@H]3[C@H](OC4=C(C=CC5=C4C[C@@H](O5)C(C)=C)C3=O)C(O)OC2=C1
MolPort-009-216-878 0.61 COC1=CC=C(C=C1OC)C(C1C(=O)OC2=CC=CC=C2C1=O)C1C(=O)OC2=CC=CC=C2C1=O
MolPort-039-751-939 0.61 CN1N=NC(COC2=CC=C3C(=O)CC4(CCCCC4)OC3=C2)=N1
MolPort-002-534-964 0.61 CC(C)C1=CC=C(NC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-002-665-447 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC(C1=CC=CC=C1)C1=CC=CC=C1)C=C2O
MolPort-005-920-097 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCC(CC1)C(N)=O)C=C2O
MolPort-005-928-032 0.61 CN(C)CC1=C2OC3(CCCCC3)CC(=O)C2=CC=C1O
MolPort-005-913-494 0.61 COCCNC(=O)CNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-000-140-119 0.61 OCC1CCC2=CC=CC=C2O1
MolPort-002-507-616 0.61 CC(=O)N1CCC2(CC1)CC(=O)C1=C(O2)C=C(O)C=C1
MolPort-002-536-333 0.61 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCC(O)CC1)C=C2O
MolPort-002-534-530 0.61 COC1=C(CNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=CC=C1
MolPort-044-723-197 0.61 OC1=CC=C([C@@H]2COC3=CC(O)=CC=C3C2)C(O)=C1
MolPort-046-068-975 0.61 CC(=O)OC1=CC=C(C=C1)C1COC2=CC(OC(C)=O)=CC=C2C1
MolPort-005-944-882 0.61 OC[C@H]1O[C@@H](OC2=CC=C3C(=O)C[C@H](OC3=C2)C2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-029-882-356 0.61 CC(C)OC1=C(C=CC=C1)C(=O)CC(=O)C1=C(O)C=C(C)C=C1
MolPort-011-968-780 0.61 COC(=O)C1COC2=CC=CC=C2C1
MolPort-035-701-903 0.61 CC(C)C1=CC=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-044-806-900 0.61 OC(=O)COC1=CC=CC2=C1C(=O)CC2
MolPort-027-869-860 0.61 CNC(=O)CC1=CC=C(CC2COC3=C(C2)C=CC(OC)=C3)C=C1
MolPort-028-738-224 0.61 COC1=CC2=C(CC(CC3=CC(OCC(N)=O)=CC=C3)CO2)C=C1
MolPort-001-741-689 0.61 OC[C@H]1O[C@@H](OC2=CC(O)=CC3=C2C(=O)CC(O3)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-022-452-215 0.61 CC1(C)CC(=O)C2=C(O1)C=CC=C2F
MolPort-008-429-433 0.61 OC(=O)CC1COC2=C(C=C(Cl)C=C2)C1=O
MolPort-027-682-924 0.61 COC1=CC=C2CC(COC2=C1)C(=O)OC1=CC=C(C=C1)C(C)(O)C(F)(F)F
MolPort-042-652-849 0.61 CC1(C)CC(=O)C2=C(O1)C=C(C=C2)C#N
MolPort-027-890-860 0.61 COC1=CC=C2CC(CC3=CC=C(CC(=O)N(C)C)C=C3)COC2=C1
MolPort-005-944-903 0.61 COC1=CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C2C(=O)[C@H](O)[C@H](OC2=C1)C1=CC(OC)=C(O)C=C1
MolPort-008-346-870 0.60 CC[C@@H](C)[C@H](NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1)C(O)=O
MolPort-006-318-255 0.60 CC[C@H](C)[C@H](NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1)C(O)=O
MolPort-005-973-106 0.60 CCC(C)C(NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1)C(O)=O
MolPort-035-872-136 0.60 FC1=C(F)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-020-360-656 0.60 CC(C)C1=CC=C(C)C2=C1OCCC2=O
MolPort-046-508-495 0.60 CC1=CC2=C(OCCC2=O)C=C1Br
MolPort-000-156-954 0.60 COC(=O)CC(=O)C1=CC=CC=C1OC
MolPort-044-203-155 0.60 CC(C)C1=CC=C2OCC[C@@]3(C[C@@H]3C(O)=O)C2=C1
MolPort-002-903-715 0.60 ClC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
MolPort-044-182-306 0.60 NC1=CC2=C(C=C1)C(=O)CC1(CCC1)O2
MolPort-046-423-317 0.60 O.O.OCC1O[C@@H](OC2=C(C(=O)CCC3=CC=C(O)C=C3)C(O)=CC(O)=C2)C(O)C(O)[C@@H]1O
MolPort-000-843-038 0.60 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCNC(=O)C1)C=C2
MolPort-019-937-364 0.60 COC1=CC=C2C(=O)CC(OC2=C1\C=C\C(C)(C)O)C1=CC=CC=C1
MolPort-003-928-949 0.60 O.O.OC[C@H]1O[C@@H](OC2=C(C(=O)CCC3=CC=C(O)C=C3)C(O)=CC(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-002-525-341 0.60 OC[C@H]1O[C@@H](OC2=C(C(=O)CCC3=CC=C(O)C=C3)C(O)=CC(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-039-338-602 0.60 CC(C)=CCC\C(C)=C/CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=C(O)C=C(O)C=C1
MolPort-020-000-545 0.60 O.O.OCC1OC(OC2=C(C(=O)CCC3=CC=C(O)C=C3)C(O)=CC(O)=C2)C(O)C(O)C1O
MolPort-007-980-749 0.60 COC1=C(OC(C)=O)C=CC(=C1)C1OC2=CC(=CC=C2O[C@@H]1COC(C)=O)[C@H]1OC2=C(C(=O)C1OC(C)=O)C(OC(C)=O)=CC(OC(C)=O)=C2
MolPort-003-847-079 0.60 [2H]C1OC2=C(C=CC(O)=C2)C([2H])([2H])C1([2H])C1=CC=C(O)C=C1
MolPort-006-417-677 0.60 BrC1COC2=CC=CC=C2C1=O
MolPort-001-761-982 0.60 CC(C)CCOC1=C(C(C)=O)C(O)=CC=C1
MolPort-002-507-289 0.60 OC1=CC=C(C=C1)[C@@H]1COC2=C(C1)C=CC(O)=C2
MolPort-003-847-077 0.60 OC1=CC=C(C=C1)C1COC2=C(C1)C=CC(O)=C2
MolPort-003-847-078 0.60 OC1=CC=C(C=C1)[C@H]1COC2=CC(O)=CC=C2C1
MolPort-019-937-223 0.60 OC[C@H]1O[C@@H](OC2=CC=C3C(=O)CC(OC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-028-855-440 0.60 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC(=O)C1=CC=CC=C1)C=C2O
MolPort-028-855-094 0.60 COC1=CC=C(C=C1)C(=O)CNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-046-689-910 0.60 COC1=CC(OC)=C(Cl)C2=C1C(=O)[C@]1(O2)[C@H](C)CC(=O)CC1=O
MolPort-013-264-365 0.60 O=C1CCCOC2=C1C=C1CCCC1=C2
MolPort-046-790-348 0.60 OC[C@H]1O[C@@H](OC2=CC=C3C(=O)C[C@H](OC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-039-052-357 0.60 OC1=CC2=C(C=C1)[C@H]1C3=CC(O)=C(O)C=C3C[C@@]1(O)CO2
MolPort-002-893-804 0.60 CS(=O)(=O)O[C@H]1[C@@H](OC2=CC=CC=C2C1=O)C1=CC=CC=C1
MolPort-000-851-544 0.60 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCC(CC1)C(O)=O)C=C2O
MolPort-002-534-987 0.60 COC1=CC=C(NC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-042-645-665 0.60 CN(C)CCOC1=CC=C(NC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-019-937-464 0.60 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C=C2
MolPort-042-675-231 0.60 OC[C@H]1O[C@@H](OC2=CC=C(C=C2)[C@@H]2CC(=O)C3=C(O2)C=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C3)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-002-677-191 0.60 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCN(CC3=CC=CC=C3)CC1)C=C2O
MolPort-003-665-706 0.60 OC1=CC2=C(C=C1)C1C3=C(CC1(O)CO2)C=C(O)C(O)=C3
MolPort-002-534-624 0.60 CC(=O)C1=CC=C(NC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-002-534-805 0.60 COC1=CC(OC)=C(CNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1
MolPort-002-535-196 0.60 COC1=CC=CC(CNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)=C1
MolPort-001-742-290 0.60 OC[C@H]1O[C@@H](OC2=CC(O)=C3C(=O)[C@@H]([C@H](OC3=C2)C2=CC=C(O)C=C2)[C@@H]2[C@H](OC3=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-005-945-874 0.60 COC1=C(O)C(OC)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1OC
MolPort-000-146-996 0.60 COC1=CC(OC)=C(C=C1)C(=O)CCCCl
MolPort-038-431-008 0.60 CCC(C)C(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-002-154-963 0.60 CC1=CC=C2OC(O)(CC(=O)C2=C1)C(F)F
MolPort-004-068-332 0.60 CCC(=O)C1=CC=CC=C1OCCOC1=CC=CC=C1C(=O)CC
MolPort-008-515-539 0.60 CCCOC1=C(C=C(C)C=C1)C(=O)CC
MolPort-002-121-266 0.60 COC1=CC2=C(OC(CC2=O)C2=CC(OC)=C(OC)C=C2)C=C1
MolPort-000-136-721 0.60 O=CC1=CC2=C(OCCC2)C=C1
MolPort-022-459-973 0.60 CC1=CC2=C(C=C1)C(=O)CCCO2
MolPort-023-276-467 0.60 CCCCCCCCCCCC(=O)C1=C(O)C(C(=O)CCCCCCCCCCC)=C(O)C(C2CC(OC3=C2C=CC(O)=C3)C2=CC=C(O)C=C2)=C1O
MolPort-008-314-242 0.60 COC(=O)CNC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-044-754-125 0.60 COC1=C2CC[C@H](OC2=C2[C@H]3C(O)[C@](OC4=CC(O)=C(C)C(OC)=C34)(OC2=C1)C1=CC=CC=C1)C1=CC=CC=C1
MolPort-012-118-747 0.60 COC1=CC2=C(C(=O)CO2)C(OC)=C1
MolPort-044-754-126 0.60 COC1=C2CC[C@H](OC2=C2[C@@H]3C(O)[C@@](OC4=CC(O)=C(C)C(OC)=C34)(OC2=C1)C1=CC=CC=C1)C1=CC=CC=C1
MolPort-035-700-180 0.60 COC1=CC(=CC2=C1OCO2)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-000-218-768 0.60 COC1=CC2=C(OC(CC2=O)C2=CC=C(C)C=C2)C=C1
MolPort-009-388-665 0.60 COC1=CC=C(C=C1)C(=O)C(C)OC(=O)C1COC2=CC=C(Cl)C=C2C1
MolPort-021-893-455 0.60 FC(F)(F)C1=CC=C2OCCC(=O)C2=C1
MolPort-002-472-731 0.60 CC1CC(=O)C2=C1C(C)=CC=C2OCC(O)=O
MolPort-002-527-151 0.60 COC1=CC2=C(O[C@@H](CC2=O)C2=CC(OC)=C(OC)C=C2)C=C1
MolPort-000-721-443 0.60 CC1=CC=C2OC(O)(CC(=O)C2=C1)C(F)(F)F
MolPort-005-916-213 0.60 CC[C@H](C)[C@@H](CO)NC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-039-339-041 0.60 OC[C@H]1O[C@@H](OC2=CC=C3C(=O)C(COC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-4230450290 0.60 CCCC1C(OCCCOC2C=CC(OCC(OC)=O)=CC=2)=CC=C(C(=O)C)C=1O
MCULE-5212157529 0.60 C1(OCCCO1)CCC(=O)C1=C(OC)C=C(OC)C=C1
MCULE-3242655498 0.60 O1C2=CC=C(C=C2CC1C(O)=O)C
MCULE-5189054328 0.60 CC1=CC2=C(C(CCO2)=O)C(C)=C1
MCULE-8823387877 0.60 C1(=C(CCCCCC)C=CC(OCC(OC)=O)=C1)OCC(OC)=O
MCULE-5084808840 0.60 FC1=CC2=C(C(CCO2)=O)C=C1
MCULE-3406690729 0.60 C1(C=CC(=CC=1OC)OC)C(=O)COC1=CC=CC=C1
MCULE-2047360187 0.60 C1(C(C)(C)CC)=CC(=CC=C1OC(CC)C(O)=O)C(C)(C)CC
MCULE-7578465182 0.60 C1=CC=CC(C(=O)CCC(=O)O)=C1OCC
MCULE-3801725063 0.60 COC1=CC(OC)=C(C(COC2=CC=C(C(C)=O)C=C2)=O)C=C1
MCULE-8270711779 0.60 C(CCOC1C=CC(=CC=1)OC)(=O)C1=CC=C(C=C1)OC
MCULE-4451098092 0.60 C1(CCC(O)=O)C(OC)=CC(=CC=1OC)OC
MCULE-3747805063 0.60 C(C1=C(OC)C=C(OC)C=C1)CC(O)=O
MCULE-8796611824 0.60 O1C2C=CC(CCC(C)(C)O)=CC=2CCC1(C)C
MCULE-6303555262 0.60 C1(C=C(C)C=CC=1OC)C(C(CC)CC)=O
MCULE-2289029488 0.60 C1(C=C(C)C=CC=1OC)C(=O)CC(C)(C)C
MCULE-9928591081 0.60 C1(C=C(C)C=CC=1OC)C(C(C)CC)=O
MCULE-5543476045 0.60 C1(C=CC(=CC=1OC)OC)C(C)CC(O)=O
MCULE-7434491066 0.60 C1(C=C(C)C=CC=1OC)C(CCC)=O
MCULE-2062918171 0.60 C1(C=C(C)C=CC=1OC)C(=O)CC(C)C
MCULE-7200238541 0.60 C1(C=C(C)C=CC=1OC)C(=O)C(C)(C)CC
MCULE-3355833721 0.60 C(=O)(C1=C(O)C=CC=C1OCC1CC1)C
MCULE-1812128087 0.60 C(O)(=O)C(C)CC1C=CC(=CC=1OC)OC
MCULE-3123185458 0.60 C1(C(=O)C2C=CC(=CC=2OCC2=CC=CC=C2)OC)C(O1)C1=CC=C2C(OCCCO2)=C1
MCULE-4062204801 0.60 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1=CC(F)=C(C(F)=C1)F)=O
MCULE-8473479842 0.60 OC1C(C/C=C(\C)/C)=CC(=CC=1OC)C1OC2C(C(=O)C1)=C(C=C(C=2)O)O
MCULE-8133441488 0.60 C1(O)C=C2O[C@]3(OC4C([C@H]([C@@H]3O)C2=C(O)C=1)=C1O[C@H](C2C=CC(O)=CC=2)[C@@H](O)[C@H](C2C(O)=CC(O)=C3C[C@H](O)[C@@H](C5C=CC(O)=CC=5)OC3=2)C1=C(O)C=4)C1C=CC(O)=CC=1
MCULE-4564815884 0.60 C12=CC(OCC3C=CC(=CC=3)Cl)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC(=CC=1)Cl
MCULE-2687134924 0.60 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC(Cl)=CC=1Cl
MCULE-6833748186 0.60 C12=C(C=CC(C(=O)C3C=CC(=CC=3)Cl)=C1O)OC(CC2C1C=CC=CC=1OCCC1C=CC2=C(CCO2)C=1)=O
MCULE-2340350799 0.60 C12=C(C=CC(C(=O)C3C=CC(=CC=3)Cl)=C1O)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-8210138916 0.60 C(OC1C(Cl)=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-4701521771 0.60 C1(=CC=C2OC(C)(C)CC(C2=C1N)=O)C(CC(N)CO)=O
MCULE-2249056813 0.60 C(OC1C(F)=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-2545026689 0.60 OS(O)(=O)=O.C1([C@H]([C@H](C2=CC(C(C)=O)=CC=C2O1)N)O)(C)C
MCULE-2685313130 0.60 O1C2C=CC=CC=2C(CC1C1C=CC2=C(OCCCCO2)C=1)=O
MCULE-7606649923 0.60 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC(C(C)CC)C(O)=O
MCULE-9078466869 0.60 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(F)C=1)F)=O
MCULE-9888998988 0.60 C1(=C(C=C2C(=C1)OCC1([H])OC3=C(C=CC4OC(C(CO)(C)Cl)CC3=4)C(=O)C21[H])OC)OC
MCULE-7472430734 0.60 C(=O)(C1C=CC=CC=1OC)CC(OC)=O
MCULE-8953246724 0.60 O=C(C1C=C2CCCOC2=CC=1)CC1OCCO1
MCULE-2583715419 0.60 C1OC2=C(C=CC(Br)=C2C)C(=O)C1
MCULE-6235263738 0.60 CC(C1=C2C(C(CCO2)=O)=C(C)C=C1)C
MCULE-6685120234 0.60 C1=C(OC)C=CC(C(=O)CCCC(=O)OCC)=C1OC
MCULE-6881330938 0.60 C12C=CC(Cl)=CC=1C(=O)CC(C1=CC=CC=C1)O2
MCULE-7764224296 0.60 C1OC2=C(C=CC(OC(F)(F)F)=C2F)C(=O)C1
MCULE-5686065252 0.60 C12=CC(Br)=CC=C1OC(CC2=O)C(OC)=O
MCULE-7383446503 0.60 C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC(=O)N1CCNC(=O)C1
MCULE-5327734531 0.60 [C@@H]1(OC2=CC(O)=CC(O)=C2C(CCC2C=CC(=CC=2)O)=O)O[C@H](CO)[C@H]([C@H](O)[C@H]1O)O
MCULE-5857598406 0.60 C1C(O)=C2C(OC(CC2=O)C2C=C(S(O)(=O)=O)C(O)=CC=2)=CC=1O
MCULE-3688020473 0.60 C1(OC2C=C(O)C=C(O)C=2C(CCC2=CC=C(C=C2)O)=O)OC(CO)C(C(O)C1O)O
MCULE-3142054999 0.60 O=C(CCC1C=CC(O)=CC=1)C1C(O)=CC(O)=CC=1O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O
MCULE-7271133303 0.60 C1(OC)C(/C=C/C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=CC=1
MCULE-1354236513 0.60 C1(O)C=C(O)C(C(=O)CCC2C=CC(O)=CC=2)=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=1
MCULE-6997931016 0.60 C1(O)C(C/C=C(\CC/C=C(\C)/C)/C)=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1
MCULE-7376385188 0.60 C1(=O)C(OC(C)=O)C(OC2C=C(C=C(OC(C)=O)C1=2)OC(C)=O)C1C=CC2=C(C=1)OC(C(COC(C)=O)O2)C1C=CC(=C(OC)C=1)OC(C)=O
MCULE-5017083843 0.60 C1(=O)C(OC(C)=O)[C@@H](C2C=CC3=C(C=2)OC([C@@H](COC(C)=O)O3)C2C=CC(=C(OC)C=2)OC(C)=O)OC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MCULE-2358119464 0.60 C1(=C(C=CC=C1O)OCCC(C)C)C(C)=O
MCULE-5874318771 0.60 C12=CC(O)=CC=C1C[C@H](CO2)C1=CC=C(C=C1)O
MCULE-4235282087 0.60 C1OC2=C(C=CC(O)=C2)C[C@@H]1C1=CC=C(O)C=C1
MCULE-6138469382 0.60 C1(C=CC(=CC=1O)OCCCC)C(=O)CC1C=CC=CC=1
MCULE-2012691567 0.60 C12=CC(OC)=CC=C1C(CO2)CCO
MCULE-1231583021 0.60 C1(O)C=C2OC[C@H](C3C=CC(O)=CC=3)CC2=CC=1
MCULE-6555642673 0.60 C12=CC(O)=CC=C1C[C@@H](CO2)C1=CC=C(C=C1)O
MCULE-7641970504 0.60 C1=CC=C(OC)C(C(CCC(=O)O)=O)=C1OC
MCULE-1358694468 0.60 C12=CC(O)=CC=C1CC(CO2)C1=CC=C(C=C1)O
MCULE-1825895362 0.60 C1(=O)C(Br)COC2=CC=CC=C12
MCULE-5274781735 0.60 C(=O)(CC(OC)=O)C1=CC=CC=C1OC(C)=O
MCULE-9661282017 0.60 C1(C=C(CC)C=CC=1OC)C(=O)CC(OCC)=O
MCULE-6854338934 0.60 O=C1C2=C(C=C3C(=C2)CCC3)OCCC1
MCULE-6713364637 0.60 C1(O)C=C2[C@]3([H])C4C=CC(O)=CC=4OC[C@]3(O)CC2=CC=1O
MCULE-7208447718 0.60 C1(O)C=C2C3C4C=CC(O)=CC=4OCC3(O)CC2=CC=1O
MCULE-8834185320 0.60 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NCC(=O)C1C=CC(=CC=1)OC
MCULE-3310374370 0.60 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCC(CC1)C(O)=O
MCULE-8532181109 0.60 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC1=CC=C(C=C1)OCCN(C)C
MCULE-6810694063 0.60 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCN(CC1)CC1C=CC=CC=1
MCULE-8543785028 0.60 [C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OS(=O)(=O)C)C1=CC=CC=C1
MCULE-4755477581 0.60 OCC1C(O)C(O)C(O)C(OC2C=C3C(=CC=2)C(CC(O3)C2=CC=C(O)C=C2)=O)O1
MCULE-2149423474 0.60 C1C=C2C(OC(C3=CC=C(O)C=C3)CC2=O)=CC=1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
MCULE-6272004922 0.60 O(C1C=CC([C@H]2OC3=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=C3C(=O)C2)=CC=1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MCULE-7991718746 0.60 O(C1C=C2O[C@H](C3C=CC(O)=CC=3)[C@]([H])(C(=O)C2=C(O)C=1)[C@]1([H])[C@@H](C2C=CC(O)=CC=2)OC2C(=C(C=C(C=2)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O)C1=O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
MCULE-4916375534 0.60 C1(C)=C(C)C=CC(CCC(=O)C2C(OC)=CC=CC=2)=C1
MCULE-7928773502 0.60 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC(OC)=C2C(OCO2)=C1)=O
MCULE-8969680562 0.60 O1C2=CC(=CC=C2C(C2C(=C(C(CCCCCCCCCCC)=O)C(=C(C(CCCCCCCCCCC)=O)C=2O)O)O)CC1C1=CC=C(C=C1)O)O
MCULE-9815958851 0.60 C12(C(O)=O)OC3=CC=C(C=C3C(=O)C1C2)Cl
MCULE-4493065840 0.60 C12=CC(OC)=CC=C1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-4656173251 0.60 C1(=CC(C)=CC=C1OCCC)C(CC)=O
MCULE-8940693646 0.60 C1(=CC(C)=CC=C1OCC(C)C)C(CC)=O
MCULE-5560242168 0.60 C1(O)(C(F)F)CC(=O)C2=C(C=CC(C)=C2)O1
MCULE-1813287210 0.60 CCC(C1=C(OCCOC2=C(C(CC)=O)C=CC=C2)C=CC=C1)=O
MCULE-5145793595 0.60 C1(=O)C2=CC=CC=C2OCC1C1C=CC(=CC=1)F
MCULE-9847328362 0.60 C12=C(C=CC(=C1)C(F)(F)F)OCCC2=O
MCULE-4669952153 0.60 C12C=CC(=CC=1OCCCC2=O)C
MCULE-2242297587 0.60 C12(C(O)=O)OC3=CC=C(C=C3C(=O)C1C2)Br
MCULE-5568663354 0.60 C1(OC)=C(C=CC(OC)=C1)CCC(OC)=O
MCULE-9665743057 0.60 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-2979677001 0.60 C12=CC(OC)=CC=C1OC(CC2=O)C1C=CC(=CC=1)C
MCULE-1986391342 0.60 C1(OC)C(O)=C(OC)C(C(=O)CCC2C=CC=CC=2)=C(O)C=1OC
MCULE-8149294051 0.60 C1(C(CCCBr)=O)C=CC(=CC=1OC)OC
MCULE-5471184122 0.60 C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC=CC=6)CCC5=C(OC)C=4)[C@H](C3O)C2=C(OC)C=1C)C1C=CC=CC=1
MCULE-3175596619 0.60 C12CCCOC1=CC=C(C=O)C=2
MCULE-1553057483 0.60 COC1=CC=C(C(C(OC(C2CC3=C(C=CC(=C3)Cl)OC2)=O)C)=O)C=C1
MCULE-4065402213 0.60 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-1533382811 0.60 C12=CC(OCOC3=C(OCC#C)C=C4C(C(=O)CC(C)(C)O4)=C3)=C(C=C1OC(C)(C)CC2=O)OCC#C
MCULE-3717616822 0.60 CC1C2=C(C=CC(OCC(O)=O)=C2C(=O)C1)C
MCULE-2027425789 0.60 C12=CC(=CC=C1C(CC1(CCCCC1)O2)=O)OCC(=O)NC(CO)C(C)CC
MCULE-8189467865 0.60 C1(=CC=C(C=C1O)OCCCCC)C(=O)CC1=CC=CC=C1
MCULE-5091684694 0.60 C(CCCCl)(C1=CC=C(OC)C=C1OC)=O
MCULE-1872541461 0.60 C1(O)(CC(=O)C2C(=CC=C(C)C=2)O1)C(F)(F)F
MCULE-9356107980 0.60 [C@@H]1(OC2=CC=C(C=C2)C2CC(=O)C3=C(C=C(C=C3)O)O2)O[C@H](CO)[C@H]([C@H](O)[C@H]1O)O
MCULE-1135807734 0.60 C1C(=O)C2C=CC(O)=CC=2O[C@@H]1C1C=CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC=1
MCULE-7432095266 0.60 C1(O)C=C2O[C@H](C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=3)CC(=O)C2=CC=1
MCULE-7039483127 0.60 C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC(=O)N1CCSCC1
MCULE-3486568584 0.60 C12=C(C=CC(C(=O)C3C=CC(=CC=3)Cl)=C1O)OC(CC2C1C=CC=CC=1OCC(OC)=O)=O
MCULE-7473832088 0.60 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC=C(C=C1)OCCCCCCCC)=O
MCULE-9039232693 0.60 CC1=CC(C)=C(OCC(COC2=C3C(C(CC3)=O)=CC=C2)O)C=C1
MCULE-7681400079 0.60 C12=CC(OCC)=CC=C1C(CC(=O)O2)C(O)=O
MCULE-5859909441 0.60 COC1=CC2=C(OCCC2=O)C=C1
MCULE-9328769556 0.60 O=C1CC(OC2C=C3OCCC3=CC=2)C1
MCULE-9633335973 0.60 C(=O)(CC(OC)=O)C1C(OC)=CC=C2C=CC=CC=12
MCULE-1360105521 0.60 C1(C=CC(=CC=1OC)OC)C(=O)C(C)(C)C
MCULE-9427468299 0.60 C(=O)(C1C=CC(=CC=1)OCCO)C(C)(C)O
MCULE-4893133539 0.60 C1=CC(=CC(OC)=C1C(CC)=O)OC
MCULE-7908962309 0.60 C1(C=CC(=CC=1OC)OC)C(C(C)C)=O
MCULE-1512726823 0.60 C1=CC=CC(CCC(=O)C2C(OC)=CC=CC=2)=C1
MCULE-9752626908 0.60 O1C(C2C=C(O)C(=C(O)C=2)O)C(OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O
MCULE-8215821193 0.60 C1C2=C(C[C@@H]([C@@H](O2)C2C=C(O)C(O)=C(O)C=2)OC(C2C=C(O)C(O)=C(O)C=2)=O)C(O)=CC=1O
MCULE-9913176697 0.60 OC1C=C2C(CC(C(C3C=CC(O)=C(O)C=3)O2)OC(C2C=C(O)C(O)=C(O)C=2)=O)=C(O)C=1
MCULE-1925476027 0.60 C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1
MCULE-7760530136 0.60 O1[C@H](C2C=C(O)C(=C(O)C=2)O)[C@H](OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O
MCULE-7508571066 0.60 C12=CC(=CC=C1C(CC1(CCCCC1)O2)=O)OCC(NCCN(CC)CC)=O
MCULE-4110327431 0.60 [C@@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1
MCULE-6064544739 0.60 C12=CC(=CC=C1C(CC1(CCCCC1)O2)=O)OCC(=O)N1CCN(CC1)CCO
MCULE-9046067244 0.60 C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O
MCULE-3341525983 0.60 C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O
MCULE-4198577169 0.60 C12=CC(=CC=C1C(CC1(CCCCC1)O2)=O)OCC(=O)N1CCN(CC1)C(C)=O
MCULE-4787916432 0.60 C12=CC(=CC=C1C(CC1(CCC(CC1)C)O2)=O)OCC(=O)N1CCN(CC1)CCO
MCULE-8110076741 0.60 C1=C(C=C2C(C[C@@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)[C@@H](C3=CC=C(C(O)=C3)O)O2)=C1O)O
MCULE-9356975267 0.60 C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)CC2=C(O)C=1
MCULE-3978866251 0.60 [C@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1
MCULE-5826766658 0.60 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(=O)N1CCN(CC1)C=O
MCULE-2467245336 0.60 C1(O)=CC(O)=C2C(O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](C2)OC(=O)C2C=C(O)C(O)=C(O)C=2)=C1
MCULE-4936843660 0.60 C1(C)C=C(N(=O)=O)C2OCC(CC3C=CC(C)=CC=3)(CO)C(=O)C=2C=1
MCULE-4787929533 0.60 C1C=C2OCCC(=O)C2=C2CCCCC2=1
MCULE-7581489437 0.60 COC1=CC=C(OCCOC2=C3C(C(CC3=O)C)=C(C)C=C2)C=C1
MCULE-7612388340 0.60 CC(C1=C(OCCOC2=C3C(C(CC3)=O)=CC=C2)C=CC=C1)=O
MCULE-2581971631 0.60 BrC1=CC2=C(C(CCCO2)=O)C=C1