SANC00360 8-O-Demethyl-7-O-methyl-3,9-dihydropunctatin




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-7026035805 1 C1(OC)C(O)=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-035-705-989 1 COC1=C(O)C2=C(C(O)=C1)C(=O)C(CC1=CC=C(O)C=C1)CO2
MCULE-2851603971 0.95 C1(O)C=C2OCC(CC3C=CC(OC)=C(O)C=3)C(=O)C2=C(O)C=1
MolPort-029-887-061 0.94 COC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1O
MolPort-035-706-506 0.91 OC1=CC2=C(C=C1)C(=O)C(CC1=CC(O)=C(O)C=C1)CO2
MCULE-8407686947 0.91 C12OC(C)(C)CC(=O)C1=CC=C(OC)C=2O
MCULE-4391957723 0.91 C1(O)C=C2OCC(CC3C=CC(O)=C(O)C=3)C(=O)C2=CC=1
MolPort-046-790-516 0.89 COC1=CC(O)=C2C(=O)C(CC3=CC=C(O)C=C3)COC2=C1
MCULE-3467826093 0.89 C12OC(CC(=O)C=1C(OC)=CC(OC)=C2OC)(C)C
MCULE-6745304759 0.88 C1C(O)=C2C(C(COC2=CC=1O)CC1C=CC(=CC=1)OC)=O
MolPort-019-937-209 0.88 COC1=CC=C(CC2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-046-761-031 0.88 COC1=CC=C(C[C@@H]2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MCULE-1736405258 0.87 C1(OC)C=CC(CC2COC3C=C(O)C=CC=3C2=O)=CC=1
MCULE-2154315081 0.87 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-035-705-988 0.87 OC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1
MolPort-019-937-486 0.87 COC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-001-766-894 0.86 CC(C)(C)C1=C(O)C(O)=C2OC(C)(C)CC(=O)C2=C1
MolPort-046-790-524 0.86 CC1=C(O)C=C2OC[C@@H](CC3=CC=C(O)C=C3)C(=O)C2=C1O
MolPort-027-720-890 0.86 COC1=CC=C(C[C@@H]2COC3=C(C2=O)C(O)=C(C)C(O)=C3C)C=C1
MCULE-7167906156 0.86 C12OC(C)(C)CC(=O)C1=CC(C(C)(C)C)=C(O)C=2O
MCULE-6672284700 0.86 C1(O)C(C)=C2OC[C@@H](CC3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1C
MCULE-2373585148 0.86 CC1C(O)=C(C)C2OCC(CC3C=CC(OC)=CC=3)C(=O)C=2C=1O
MCULE-8240919679 0.86 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-7325867187 0.86 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OCC
MCULE-5956278100 0.86 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OC
MolPort-002-486-330 0.86 OC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-001-793-312 0.86 COC1=CC2=C(C=C1OC)C(=O)CC(C)(C)O2
MolPort-039-338-316 0.84 COC1=C(O)C(OC)=C2C(=O)C[C@H](OC2=C1OC)C1=CC=CC=C1
MCULE-5742809714 0.84 C1(OC)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1O
MCULE-8926090259 0.84 C1(OC)C(O)=C2O[C@H](CC(C2=C(O)C=1)=O)C1C(O)=CC=CC=1
MCULE-5089786365 0.84 C12C(OC)=CC(=CC=1OC(C)(C)CC2=O)OC
MolPort-001-742-179 0.84 COC1=CC(O)=C2C(=O)C[C@@H](OC2=C1O)C1=CC=CC=C1O
MolPort-039-052-403 0.83 COC1=C2C(=O)C[C@H](OC2=C(OC)C(O)=C1)C1=CC=CC=C1
MolPort-005-944-620 0.83 COC1=CC(O)=C2C(=O)CC(OC2=C1OC)C1=CC=CC=C1
MolPort-035-683-131 0.83 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1OC)C1=CC=CC=C1
MCULE-9602960797 0.83 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-8847685016 0.83 COC1C=C(O)C(OC)=C2C=1C(CC(C1C=CC=CC=1)O2)=O
MCULE-4193314774 0.83 OC1=C2C(C[C@@H](C3C=CC=CC=3)OC2=C(OC)C(OC)=C1)=O
MCULE-5082193272 0.83 O1C2=C(C)C(=C(C)C(=C2C(C(C1)CC1=CC=C2C(=C1)OCO2)=O)O)O
MCULE-8753334659 0.83 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C
MCULE-8143016945 0.83 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OC
MolPort-027-720-889 0.83 CC1=C(O)C(C)=C2OCC(CC3=CC=C4OCOC4=C3)C(=O)C2=C1O
MolPort-046-158-530 0.83 COC1=C(O)C=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-020-005-879 0.83 CC1=C(O)C2=C(OC[C@@H](CC3=CC=C4OCOC4=C3)C2=O)C(C)=C1O
MolPort-002-126-253 0.83 COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-002-507-617 0.82 CC1CCC2(CC1)CC(=O)C1=C(O2)C(O)=C(O)C=C1
MolPort-000-857-226 0.82 OC1=C(O)C2=C(C=C1)C(=O)CC1(CCCCC1)O2
MCULE-8980836702 0.82 C12OC3(CCCCC3)CC(=O)C=1C=CC(O)=C2O
MCULE-2510689712 0.82 C12OC3(CCC(CC3)C)CC(=O)C=1C=CC(O)=C2O
MCULE-6923632463 0.82 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1O
MCULE-1173100593 0.82 C12C=C(OC)C=CC=1C(CC(C)O2)=O
MCULE-2940029331 0.82 C12C=C(OCCC)C=CC=1C(CC(C)(C)O2)=O
MCULE-5357665740 0.82 C12=CC(OC)=CC=C1C(CC(C)(C)O2)=O
MolPort-001-742-743 0.82 OC1=C(O)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-002-904-439 0.82 COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-002-855-621 0.82 CCCOC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-039-338-699 0.81 COC1=C(OC)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-001-739-249 0.81 CCC1=C2O[C@H](C)CC(=O)C2=C(OC)C=C1O
MolPort-039-339-057 0.81 CC1=C2OC[C@@H](CC3=CC4=C(OCO4)C=C3)C(=O)C2=C(O)C(C=O)=C1O
MCULE-2232530891 0.81 C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-2924473141 0.81 C1C(=C2C(=C(C=1O)CC)O[C@H](C)CC2=O)OC
MCULE-1782797624 0.81 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C=O
MCULE-5463631459 0.81 C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-9575020223 0.81 C1(O)C(O)=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-5732404629 0.81 C12OC(CC(=O)C1=CC=C(OC)C=2C)(C)C
MolPort-044-754-077 0.81 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(OC)C(O)=C1
MolPort-044-754-063 0.81 OC1=CC=C2C(=O)C[C@H](OC2=C1O)C1=CC(O)=C(O)C=C1
MolPort-002-910-535 0.81 COC1=C(C)C2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-002-054-240 0.80 CC1(C)CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-044-723-238 0.80 COC1=C2C(=O)C[C@H](OC2=C(OC)C(O)=C1)C1=C(O)C=CC=C1
MolPort-001-740-631 0.80 COC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-039-338-620 0.80 COC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MCULE-1219453843 0.80 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)O
MCULE-3921944108 0.80 O=C1C2C(OC)=C(C=O)C(O)=CC=2OC(C)(C)C1
MCULE-3601358321 0.80 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-9660679251 0.80 C1(O)C=C2OC(CC(C2=C(O)C=1OC)=O)C1C=CC=CC=1
MCULE-1702737025 0.80 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(OC)C=1
MCULE-9044534531 0.80 C12C(O)=CC(O)=CC=1OC(CC2=O)C1C=CC(OC)=C(O)C=1
MCULE-2236290715 0.80 C12=C(O)C=C(O)C=C1O[C@H](CC2=O)C1=CC=C(OC)C(O)=C1
MCULE-7131810532 0.80 C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)O
MCULE-9396529091 0.80 C1(O)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-4928479927 0.80 C1(OC)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-2703837005 0.80 C1(OC)C=C2OC(CC(C2=C(O)C=1)=O)C1C=CC(O)=C(O)C=1
MCULE-2028448851 0.80 C1(O)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-7830277688 0.80 C1(OC)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-4912537449 0.80 C1(CO)(CC2=CC=C(C=C2)OC)COC2C(=CC=CC=2)C1=O
MolPort-002-893-747 0.80 COC1=C(O)C=C(C=C1)[C@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-028-599-906 0.80 COC1=CC2=C(C(=O)C[C@H](O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-046-689-929 0.80 [2H]C([2H])([2H])OC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-003-665-801 0.80 COC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-000-769-419 0.80 COC1=CC2=C(C(=O)CC(O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-001-741-418 0.80 COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-002-818-093 0.80 COC1=CC=C(CC2(CO)COC3=CC=CC=C3C2=O)C=C1
MolPort-046-687-425 0.80 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=CC(O)=C(O)C=C2O1
MolPort-035-706-525 0.80 COC1=CC2=C(C(=O)C[C@H](O2)C2=CC(O)=CC(O)=C2)C(O)=C1
MolPort-039-052-506 0.79 COC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-005-945-286 0.79 COC1=C(O)C=C2O[C@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-046-761-034 0.79 COC1=CC=C(C[C@]2(O)COC3=CC(OC)=CC(O)=C3C2=O)C=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 0.79 COC1=CC(OC)=C2C(=O)CCOC2=C1
MCULE-4193299594 0.79 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-7447091722 0.79 O=C1C2C(OC)=C(C(=O)C)C(O)=CC=2OC(C)(C)C1
MCULE-1362714791 0.79 O=C1C2C(=CC=CC=2OC(C)(C)C1)OC
MCULE-1941541843 0.79 C12C=C(O)C=CC=1C(CC(C)(C)O2)=O
MCULE-1588072136 0.79 C12C(CCOC=1C=C(OC)C=C2OC)=O
MCULE-1890542536 0.79 C1(O)C2C(CC(C3C=C(O)C(OC)=CC=3)OC=2C=C(OC)C=1OC)=O
MCULE-8793012880 0.79 C(C)(=O)OC1=CC2=C(C(C(C(C)O2)C(C)=O)=O)C=C1
MCULE-9260449258 0.79 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3OC)CC(=O)C2=C(OC)C=1
MCULE-9497505068 0.79 C12OC(C)(C)CC(=O)C1=CC=C(O)C=2C
MCULE-6813410114 0.79 C12=CC(OCC3C=CC=CC=3)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC=CC=1
MolPort-003-849-812 0.79 COC1=CC(OC)=C2C(=O)CC(OC2=C1)C1=CC(OC)=C(OC)C(OC)=C1
MolPort-035-683-119 0.79 COC1=C(C=CC=C1)[C@@H]1CC(=O)C2=C(OC)C=C(O)C(OC)=C2O1
MolPort-000-145-684 0.79 CC1=C(O)C=CC2=C1OC(C)(C)CC2=O
MolPort-046-158-531 0.79 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(O)C=C1
MolPort-001-740-717 0.78 COC1=CC(OC)=C2C(=O)CC(OC2=C1)C1=CC=CC=C1
MolPort-046-790-389 0.78 COC1=CC(OC)=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-046-158-465 0.78 COC1=CC=C(C[C@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-035-683-128 0.78 COC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=C(O)C=CC=C1
MolPort-046-153-729 0.78 OC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=CC(O)=C(O)C=C2O1
MolPort-001-740-726 0.78 OC1=CC2=C(C(=O)CC(O2)C2=CC(O)=C(O)C=C2)C(O)=C1
MolPort-003-938-846 0.78 OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=C(O)C(O)=C2)C(O)=C1
MCULE-7275500281 0.78 C1(OC)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC=CC=1
MCULE-9922758733 0.78 C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1
MCULE-6709417192 0.78 C(#N)COC1=CC2OC(C)(C)CC(=O)C=2C=C1
MCULE-8635359097 0.78 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1O
MCULE-5444072692 0.78 OC1C2C(=O)CC3(OC=2C=C(O)C=1)CC3
MCULE-3225229511 0.78 C1(O)C(O)=CC([C@H]2OC3C=C(O)C=C(O)C=3C(=O)C2)=CC=1
MCULE-8678602121 0.78 C1(O)=CC(O)=C2C(CC(C3C=CC(O)=C(O)C=3)OC2=C1)=O
MCULE-1688833251 0.78 C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-5247936822 0.78 C12OC(C)(CCC(O)=O)CC(=O)C1=CC=C(OC)C=2OC
MCULE-3924606015 0.78 C1(O)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-8068976578 0.78 C12C(OC)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)OC
MCULE-8498690406 0.78 COC1=CC(OC)=CC2=C1C(=O)CC(C1=CC=C(OC)C=C1)O2
MCULE-2855478624 0.78 C1(O)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-1231893585 0.78 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-7008971924 0.78 C1(=O)C(C=O)C(C)(C)OC2=CC=C(OC)C=C12
MolPort-008-441-963 0.78 COC1=C(OC)C2=C(C=C1)C(=O)CC(C)(CCC(O)=O)O2
MolPort-046-158-525 0.78 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(OC)C=C1
MolPort-035-683-148 0.78 OC1=CC(=CC(O)=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-039-052-470 0.78 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(OC)C=C(OC)C=C2O1
MolPort-039-338-389 0.78 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(OC)C=C(O)C=C2O1
MolPort-007-981-120 0.78 COC1=CC2=C(OC(C)(C)C(C=O)C2=O)C=C1
MolPort-023-279-019 0.77 COC1=CC(=CC(O)=C1OC)[C@@H]1CC(=O)C2=C(O)C(OC)=C(O)C=C2O1
MolPort-046-790-523 0.77 OC1=CC=C(C[C@@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-001-740-709 0.77 COC1=C2C(=O)CC(OC2=CC(O)=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-007-926-743 0.77 CC1(C)CC(=O)C2=C(O1)C=CC(O)=C2
MolPort-001-741-519 0.77 COC1=CC(O)=C2C(=O)C[C@@H](OC2=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-021-482-677 0.77 COC1=CC=CC2=C1OC(C)(C)CC2=O
MolPort-003-873-390 0.77 CC1(C)CC(=O)C2=C(O1)C=CC=C2O
MolPort-039-338-317 0.77 OC1=CC=C2C(=O)C[C@H](OC2=C1)C1=CC(O)=C(O)C=C1
MolPort-001-740-173 0.77 OC1=CC=C2C(=O)CC(OC2=C1)C1=CC(O)=C(O)C=C1
MolPort-035-705-965 0.77 OC1=CC=C2C(=O)C[C@H](OC2=C1)C1=CC(O)=C(O)C(O)=C1
MolPort-038-387-877 0.77 COC1=CC=C2C(=O)CC(OC2=C1)C1=CC=C(OC)C(OC)=C1
MolPort-003-804-010 0.77 COC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC(OC)=C(OC)C(OC)=C1
MCULE-8000658254 0.77 C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(OC)C=3)CC(=O)C2=C(O)C=1OC
MCULE-5052743999 0.77 O=C1C2C(=CC(=CC=2OC(C2C=CC=CC=2)C1)OC)O
MCULE-8084114235 0.77 [C@H]1(C2=CC=CC=C2)OC2=CC(O)=CC(OC)=C2C(=O)C1
MCULE-7196504979 0.77 C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-7826903505 0.77 C1(O)C=C2OC(C3C=CC=CC=3)CC(C2=C(OC)C=1)=O
MCULE-7258052902 0.77 C1(OC)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-6305563775 0.77 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-3818653032 0.77 C12=CC(O)=CC=C1OC(CC2=O)(C)C
MCULE-2962679821 0.77 OC1C2C(=O)CC(OC=2C=C(O)C=1C(=O)C)(C)C
MCULE-1994873281 0.77 COC1=C2C(C(CC(O2)(C)C)=O)=CC=C1
MCULE-1718966435 0.77 CC1(OC2=C(C(=CC=C2)O)C(=O)C1)C
MCULE-9899038190 0.77 OC1C=C2OC(C3C=CC(O)=C(O)C=3)CC(C2=CC=1)=O
MCULE-6906830879 0.77 C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-1131774635 0.77 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-9660563348 0.77 C12C=CC(OC)=CC=1OC(CC2=O)C1C=CC(OC)=C(OC)C=1
MCULE-8978551782 0.77 COC1=CC(C2OC3C=C(OC)C=CC=3C(=O)C2)=CC(OC)=C1OC
MCULE-4427780251 0.77 C12=C(C)C(OC)=CC(O)=C1C(CC(C1C=CC=CC=1)O2)=O
MCULE-8293297438 0.77 C12C=CC(=CC=1OCCC2=O)OC
MCULE-3324355674 0.77 C1(C=C2OC(CC(C2=C(O)C=1)=O)C1=CC=C(O)C(OC)=C1)O
MCULE-9587381415 0.77 C1(O)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3441155287 0.77 C12OC(CC(=O)C=1C=CC(OCC(=O)C)=C2C)(C)C
MCULE-2862082028 0.77 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1
MCULE-9865914914 0.77 C1(O)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC(O)=CC=1
MCULE-6698275589 0.77 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-1297538743 0.77 C1(OC)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-3240859900 0.77 C1(OC)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-3666139069 0.77 C12=CC(OCCOC3=CC=C4C(OC(CC4=O)(C)C)=C3)=CC=C1C(CC(C)(C)O2)=O
MCULE-5756285409 0.77 OC1C2C(=O)CC3(OC=2C=C(O)C=1)CCC3
MolPort-003-712-357 0.77 COC1=CC2=C(C=C1)C(=O)CCO2
MolPort-001-740-728 0.77 COC1=C(O)C=CC(=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-046-153-732 0.77 COC1=CC(=CC=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-001-842-621 0.77 CC(=O)COC1=C(C)C2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-005-944-711 0.77 COC1=C2C(=O)CC(OC2=CC(O)=C1)C1=CC=C(O)C=C1
MolPort-035-683-182 0.77 COC1=C2C(=O)C[C@H](OC2=CC(O)=C1)C1=CC=C(O)C=C1
MolPort-035-683-158 0.77 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(OC)C=C2O1
MolPort-000-165-376 0.77 COC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC=C(O)C=C1
MolPort-039-052-519 0.77 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-001-739-248 0.76 COC1=C2C(=O)C[C@@H](C)OC2=C(CCO)C(O)=C1
MolPort-035-683-202 0.76 CC1(C)CCC2=C3O[C@@H](CC(=O)C3=C(O)C=C2O1)C1=CC=CC=C1
MolPort-039-338-418 0.76 COC1=C(C)C(O)=C2C(=O)C[C@H](OC2=C1C)C1=CC=C(O)C=C1
MCULE-4510679729 0.76 C1C(OC)=C2C(=O)C[C@@H](C)OC2=C(C=1O)CCO
MCULE-9332914030 0.76 C12C=C(OC)C=CC=1C(CC(C1C=CC=CC=1)O2)=O
MCULE-8604836333 0.76 C12OC(C)(C)CCC1=C1O[C@H](C3C=CC=CC=3)CC(=O)C1=C(O)C=2
MCULE-4547911471 0.76 C1(OC)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-1272280425 0.76 C12C(=O)CC(OC=1C=C(OC)C(C)=C2O)C1C=CC=CC=1
MCULE-7916081306 0.76 C12=CC(=CC=C1OCC(C(=O)C)C2=O)C
MCULE-3718545840 0.76 C12=C(C)C=C(C=C1OC(CC2=O)(C)C)O
MCULE-9439004515 0.76 C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)OC)O
MCULE-6964743359 0.76 C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=CC=1)OC)O
MolPort-000-145-683 0.76 CC1=CC(O)=CC2=C1C(=O)CC(C)(C)O2
MolPort-002-893-167 0.76 CC(=O)C1COC2=C(C=C(C)C=C2)C1=O
MolPort-028-599-887 0.76 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-001-742-462 0.76 COC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
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-039-338-107 0.75 CC1=C(O)C(C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-002-507-573 0.75 CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2O
MolPort-001-740-535 0.75 CC1=C(O)C(C)=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-338-427 0.75 COC1=C(C)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-008-822-103 0.75 COC1=CC2=C(OC(C)(C)CC2=O)C=C1
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-1335950835 0.75 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(O)=O
MCULE-5863118612 0.75 C12=CC(OC)=CC=C1C(CC1(CCCCC1)O2)=O
MCULE-6580599773 0.75 C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-4107309014 0.75 C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-5001672302 0.75 C1(C)C(O)=C2C(CC(OC2=C(C)C=1O)C1C=CC(O)=CC=1)=O
MCULE-9997080281 0.75 COC1=CC2=C(OC(CC2=O)(C)C)C=C1
MCULE-6753110271 0.75 C12=C(C)C(O)=CC(O)=C1C(C[C@@H](C1C=CC=CC=1)O2)=O
MCULE-3254872691 0.75 C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MCULE-5852778653 0.75 C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MCULE-5489217450 0.75 C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)O
MCULE-2527326110 0.75 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-4005429744 0.75 C1C(=O)C2=C(O)C=C(O)C=C2O[C@@H]1C1C=CC(O)=CC=1
MCULE-8640026575 0.75 C12C=CC(=CC=1OCCC2=O)O
MCULE-2417211351 0.75 O=C1C2C(=CC=CC=2OCC1)OC
MCULE-3334832041 0.75 C12C=C(OC)C=CC=1C(CC(C1C=CC=C(OC)C=1OC)O2)=O
MCULE-7233709477 0.75 C12C(=O)CC(OC=1C(=C(O)C(C)=C2O)C=O)C1=CC=CC=C1
MCULE-2337043419 0.75 C12C=C(C=CC=1C(CC(C1=CC=CC=C1)O2)=O)O
MCULE-8743190189 0.75 C12C(=CC=CC=1OC(CC2=O)C1=CC=CC=C1)OC
MCULE-7123585792 0.75 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(C1C=CC=CC=1)=O
MCULE-8726416131 0.75 C1(O)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=CC=1
MolPort-001-796-145 0.75 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-000-861-091 0.75 OC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-002-507-277 0.75 OC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-006-417-667 0.75 OC1=CC=C2C(=O)CCOC2=C1
MolPort-020-001-853 0.75 COC1=CC=CC2=C1C(=O)CCO2
MolPort-001-742-469 0.75 COC1=CC=CC2=C1C(=O)CC(O2)C1=CC=CC=C1
MolPort-002-903-717 0.75 OC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC=CC=C1
MolPort-039-338-586 0.75 OC1=CC=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
MolPort-000-693-539 0.75 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=CC=C1)C=C2O
MolPort-035-699-864 0.74 COC1=C(OC(C)C)C=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-701-515 0.74 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-044-431-402 0.74 OC1=CC2=C(C(=O)CC3(CCCCC3)O2)C(O)=C1
MolPort-002-507-621 0.74 CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2
MolPort-046-158-489 0.74 CC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-001-740-534 0.74 CC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-013-264-378 0.74 O=C1CCOC2=C1C=C1OCOC1=C2
MolPort-039-339-073 0.74 CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
MolPort-009-683-119 0.74 COC1=CC2=C(C=C1)C(=O)CCCO2
MolPort-046-591-306 0.74 CC1=C2OCCC(=O)C2=CC=C1O
MolPort-035-701-225 0.74 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-616 0.74 COC1=C(OC)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MCULE-5841905312 0.74 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC(C)C)=O
MCULE-8733210430 0.74 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-7104867839 0.74 C1(C)C(O)=C2C(CC(OC2=CC=1O)C1C=CC(O)=CC=1)=O
MCULE-8195585327 0.74 C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-1362087997 0.74 O=C1C2=C(C=C3C(=C2)OCO3)OCC1
MCULE-6542351856 0.74 C12C(O)=CC(=CC=1OC1(CC2=O)CCCCC1)O
MCULE-4553065305 0.74 C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O
MCULE-6630170807 0.74 C12=CC=C(C=C1OCCCC2=O)OC
MCULE-9126215246 0.74 O=C1CCOC2=C1C=CC(O)=C2C
MCULE-3906381675 0.74 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O
MCULE-7295377199 0.74 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C(OC)C=1)OC)=O
MCULE-1986391342 0.74 C1(OC)C(O)=C(OC)C(C(=O)CCC2C=CC=CC=2)=C(O)C=1OC
MCULE-2064774552 0.74 OC1C=CC(C2OC3=CC(O)=CC=C3C(=O)C2)=CC=1
MCULE-5306878717 0.74 C12=CC(O)=CC=C1C(=O)C[C@@]([H])(C1C=CC(=CC=1)O)O2
MCULE-5637234780 0.74 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1
MCULE-6674323180 0.74 C12=CC(OC)=CC=C1C(=O)CC(C1=CC=C(C=C1)C(O)=O)O2
MCULE-1252928951 0.74 Cl.C12C=C(C=CC=1C(CC(C)(C)O2)=O)OCC(O)=O
MCULE-8328465292 0.74 C1=C(O)C=C2C=C3C(=C(C2=C1OC)O)C(=O)CC(O)(C)O3
MolPort-005-945-874 0.74 COC1=C(O)C(OC)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1OC
MolPort-005-944-750 0.74 OC1=CC=C(C=C1)C1CC(=O)C2=CC=C(O)C=C2O1
MolPort-002-511-352 0.74 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2
MolPort-000-157-924 0.74 COC(=O)CC(=O)C1=CC=C(OC)C(OC)=C1OC
MolPort-008-602-942 0.74 COC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC=C(C=C1)C(O)=O
MolPort-001-739-255 0.74 COC1=CC(O)=CC2=CC3=C(C(=O)CC(C)(O)O3)C(O)=C12
MolPort-000-855-697 0.74 Cl.CC1(C)CC(=O)C2=C(O1)C=C(OCC(O)=O)C=C2
MolPort-016-634-562 0.73 COC1=CC(C)=CC2=C1OCCC2=O
MolPort-001-742-520 0.73 COC1=CC(O)=C(C(=O)CCC2=CC=C(OC)C(OC)=C2)C(OC)=C1
MolPort-016-588-829 0.73 CC1CCCC2(C1)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-003-757-724 0.73 CC(C)(C)C1CC[C@@]2(CC1)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-038-550-587 0.73 CC(C)(C)C1CCC2(CC1)CC(=O)C1=CC=C(O)C=C1O2
MolPort-003-757-722 0.73 CC1CC[C@@]2(CC1)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-002-507-615 0.73 OC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-035-683-126 0.73 CC(=O)OC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-002-823-531 0.73 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-002-507-620 0.73 COC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-039-052-621 0.73 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
MCULE-7708554044 0.73 COC1=C2C(C(CCO2)=O)=CC(C)=C1
MCULE-6484075620 0.73 C1(C(CCC2C=CC(=C(OC)C=2)OC)=O)C(OC)=CC(=CC=1O)OC
MCULE-1466259365 0.73 C1(C(=O)CCC(=O)O)=CC(=C(OCC)C=C1OCC)OCC
MCULE-6916263915 0.73 C12C=C(O)C=CC=1C(CC1(CCC(CC1)C)O2)=O
MCULE-6863370760 0.73 C12C=C(O)C=CC=1C(CC1(CCCCC1)O2)=O
MCULE-4398219856 0.73 C12C=C(O)C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O
MCULE-1897206983 0.73 C12C=C(O)C=CC=1C(CC1(CCCC(C)C1)O2)=O
MCULE-5423915532 0.73 C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-8810069198 0.73 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-6367958739 0.73 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(OC)=O
MCULE-1533382811 0.73 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-4496634668 0.73 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-6583593892 0.73 C12=CC(C=O)=CC(OC)=C1OCCC2=O
MCULE-7323133778 0.73 COC1=C2C(C(CCO2)=O)=CC=C1
MCULE-7443154930 0.73 C12C=C3C(OCCC3=O)=CC=1OCCC2=O
MCULE-1243164622 0.73 C12C=C(OC)C=CC=1OC(C1=CC=C(OC)C=C1)CC2=O
MCULE-9278940968 0.73 C1C(=C2C(=O)C[C@H](OC2=C2CCOC=12)C)OC
MCULE-4742880627 0.73 O=C1C2C=C(C=CC=2OCC1)O
MCULE-9150854361 0.73 C12=CC(OC)=CC=C1CC(CO2)C=O
MCULE-2424476488 0.73 C12C=C(O)C=CC=1OC(CC2=O)C1=CC=CC=C1
MCULE-6451111457 0.73 C12C=C(O)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MCULE-8224104004 0.73 C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-9197350217 0.73 C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)CC(=O)C2=C(O)C=1
MCULE-7967112504 0.73 C1(O)C=C(OC)C(C(=O)CCC2C=CC=CC=2)=C(O)C=1OC
MCULE-9196167573 0.73 C12C(CCC(C)(C)O1)=CC(C=O)=C(OC)C=2
MolPort-003-804-009 0.73 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC(OC)=C2
MolPort-008-645-277 0.73 COC1=CC=CC2=C1OCCC2=O
MolPort-002-911-518 0.73 O=C1CCOC2=CC3=C(C=C12)C(=O)CCO3
MolPort-005-944-003 0.73 COC1=C2C(=O)C[C@@H](C)OC2=C2CCOC2=C1
MolPort-003-803-117 0.73 OC1=CC2=C(OCCC2=O)C=C1
MolPort-046-596-299 0.73 OC1=CC2=C(O[C@@H](CC2=O)C2=CC=CC=C2)C=C1
MolPort-001-792-222 0.73 OC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
MolPort-035-706-517 0.73 COC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC(O)=C(OC)C=C1
MolPort-029-943-067 0.73 OC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=C(O)C=CC=C1O
MolPort-000-165-372 0.73 COC1=CC(O)=C(OC)C(O)=C1C(=O)CCC1=CC=CC=C1
MolPort-003-803-440 0.73 COC1=C(C=O)C=C2CCC(C)(C)OC2=C1
MolPort-044-184-424 0.73 OC1=CC=CC2=C1C(=O)CCO2
MolPort-002-855-328 0.72 O=C1C2=CC=CC=C2OCC11CC1C1=CC=CC=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-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-002-819-128 0.72 CC1CC(=O)C2=C(O1)C=CC(C)=C2
MolPort-003-803-580 0.72 CC1(C)CCC2=CC(C(O)=O)=C(O)C(O)=C2O1
MolPort-023-298-961 0.72 CC(=O)C1=CC=C2OC(C)(C)CC(=O)C2=C1
MolPort-005-909-341 0.72 COC(=O)COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-039-079-516 0.72 CC(C)OCC(O)COC1=CC=C2C(=O)CC(C)(C)OC2=C1
MolPort-000-734-672 0.72 CC(=O)OC1=CC2=C(C(=O)C[C@H](O2)C2=CC=CC=C2)C(OC(C)=O)=C1
MolPort-002-527-151 0.72 COC1=CC2=C(O[C@@H](CC2=O)C2=CC(OC)=C(OC)C=C2)C=C1
MolPort-002-121-266 0.72 COC1=CC2=C(OC(CC2=O)C2=CC(OC)=C(OC)C=C2)C=C1
MCULE-7442958115 0.72 OC1C=CC(C2OC3C(C(=O)C2)=C(O)C=C(O)C=3)=C(O)C=1
MCULE-6209828622 0.72 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCCCO2)C=1
MCULE-6359355499 0.72 C12C=C(OC)C=CC=1O[C@@](CC2=O)([H])C1C=CC2=C(OCCCCO2)C=1
MCULE-7760204952 0.72 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)CC1C=CC=CC=1
MCULE-1480766301 0.72 C1(OC)=CC(O)=C2C([C@@H]([C@@H](C3C=CC(O)=C(O)C=3)OC2=C1)O)=O
MCULE-1856015315 0.72 O(C)C1C=CC([C@H]2OC3=CC(O)=CC(O)=C3C([C@@H]2O)=O)=CC=1O
MCULE-7359426276 0.72 CC1(OC2=C(C=CC=C2)C(=O)C1)C
MCULE-1708111551 0.72 O1CCCC(=O)C2=CC(C)=C(O)C=C12
MCULE-3930952492 0.72 OCC1(COC1)COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1
MCULE-5242974703 0.72 C1(OC)C(CC(O)C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-7513860584 0.72 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 0.72 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-7988809823 0.72 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-8141390165 0.72 C12=CC(O)=CC=C1OC1(CC2=O)CCCCC1
MCULE-2739952519 0.72 C12=CC(O)=CC=C1OC1(CC2=O)CCCCCC1
MCULE-4049182556 0.72 C12=CC(O)=CC=C1OC1(CC2=O)CCC(CC1)C
MCULE-7797086388 0.72 O1C2C=CC=CC=2C(CC1C1C=CC(=C(OC)C=1)OC)=O
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-4564815884 0.72 C12=CC(OCC3C=CC(=CC=3)Cl)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC(=CC=1)Cl
MCULE-1920414499 0.72 C1(C(O)=O)=CC2=C(OC(CC2)(C)C)C(O)=C1O
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-7803942227 0.72 CC1=CC2C(=O)CC(C)(C)OC=2C=C1
MCULE-8819587770 0.72 C(OC1=CC2OCCC(=O)C=2C=C1)(=O)C(C)(C)C
MCULE-1657871638 0.72 C1C=C2OC(C)(C)CC(=O)C2=CC=1C(C)=O
MCULE-8793789355 0.72 CC(OCC(COC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)O)C
MCULE-2611502602 0.72 C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC(=O)C)C=1
MCULE-4756469832 0.72 C12C(OC(C)=O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC=CC=1)OC(C)=O
MCULE-4065402213 0.72 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-4493065840 0.72 C12=CC(OC)=CC=C1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-5645387008 0.72 C12OC3(CCNCC3)CC(=O)C1=CC=C(OC)C=2OC
MCULE-6551547790 0.72 C1(OC)C=C2C(=O)CC3(CCNCC3)OC2=CC=1OC
MCULE-9912369691 0.72 C1(C(CCCCCCCCC)=O)=CC=C(C=C1OCCCCCCCC)OCCCCCCCC
MCULE-7259979801 0.72 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1
MolPort-035-705-966 0.72 OC1=CC=C([C@@H]2CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)=C1
MolPort-005-945-643 0.72 OC1=CC(O)=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-000-659-580 0.72 COC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCCCO3)C=C2)C=C1
MolPort-002-529-927 0.72 COC1=CC2=C(O[C@H](CC2=O)C2=CC3=C(OCCCCO3)C=C2)C=C1
MolPort-002-833-163 0.72 CC1(C)CC(=O)C2=C(O1)C=C(CC1=CC=CC=C1)C=C2O
MolPort-001-741-843 0.72 COC1=C(O)C=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-001-740-727 0.72 COC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC(O)=C(O)C=C1
MolPort-000-679-470 0.72 CC1(C)CC(=O)C2=C(O1)C=CC=C2
MolPort-038-948-087 0.72 C[C@@H]1CC(=O)C2=C(O1)C=CC=C2
MolPort-046-761-030 0.72 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-039-338-970 0.72 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-028-771-904 0.72 OCC1(COC2=CC=C3C(=O)CC4(CCCCC4)OC3=C2)COC1
MolPort-019-937-045 0.72 COC1=CC(OC)=C2C(=O)CC(OC2=C1CC(O)C(C)(C)O)C1=CC=CC=C1
MolPort-039-338-895 0.72 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-039-338-973 0.72 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-007-673-710 0.72 OC1=CC2=C(OC3(CC2=O)CCCCCC3)C=C1
MolPort-006-327-481 0.72 OC1=CC2=C(OC3(CCCCC3)CC2=O)C=C1
MolPort-007-673-742 0.72 CC1CCC2(CC1)CC(=O)C1=C(O2)C=CC(O)=C1
MolPort-035-701-873 0.71 CC(C)OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-496 0.71 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC=CC=C4)C3=C2O1
MolPort-035-700-507 0.71 COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-700-991 0.71 COC1=CC(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-699-893 0.71 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-038-966-001 0.71 CC1(C)CC(=O)C2=CC=C(OCC(O)CC(F)(F)F)C=C2O1
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-000-659-581 0.71 O=C1CC(OC2=C1C=CC=C2)C1=CC2=C(OCCCCO2)C=C1
MolPort-008-640-982 0.71 Cl.COC1=C(OC)C2=C(C=C1)C(=O)CC1(CCNCC1)O2
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-046-689-930 0.71 COC1=C(OC(C)=O)C=C(C=C1)C1CC(=O)C2=C(OC(C)=O)C=C(O)C=C2O1
MolPort-002-915-229 0.71 CC1=CC(OCC2=CC=CC=C2)=CC2=C1C(=O)CC(C)(C)O2
MolPort-046-689-931 0.71 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-002-914-759 0.71 CC1=CC(OCC(O)=O)=CC2=C1C(=O)CC(C)(C)O2
MolPort-019-937-559 0.71 COC1=C(O)C=C2O[C@@H]([C@@H](O)C(=O)C2=C1)C1=CC=CC=C1
MolPort-000-674-952 0.71 COC1=C(OC)C=C(C=C1)C1CC(=O)C2=C(O1)C(C)=CC(C)=C2
MolPort-002-718-926 0.71 COC1=CC2=C(C(=O)C(O)C(O2)C2=CC(OC)=C(OC)C=C2)C(OC)=C1
MCULE-8501275024 0.71 CC1(OC2=C(C=CC(=C2)OCC(CC(F)(F)F)O)C(=O)C1)C
MCULE-2685313130 0.71 O1C2C=CC=CC=2C(CC1C1C=CC2=C(OCCCCO2)C=1)=O
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-9292245335 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC=C(C=C1)OC(C)C)=O
MCULE-8064214931 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-2305079825 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1)=O
MCULE-9848014448 0.71 Cl.C12OC3(CCNCC3)CC(=O)C1=CC=C(OC)C=2OC
MCULE-5907594280 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OC)=O
MCULE-1434608117 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)OC)=O
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-6772374144 0.71 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC=CC=1
MCULE-7305711707 0.71 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC(=O)O
MCULE-7268905540 0.71 C12=C(C)C=C(C=C1C(CC(C1=CC=C(C(OC)=C1)OC)O2)=O)C
MCULE-3493265138 0.71 C12C(OC)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(OC)C=1)OC)OC
MCULE-2109953476 0.71 C12C3=CC=CC=C3C=CC=1C(CC(C)(C)O2)=O
MCULE-2605725094 0.71 C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MCULE-1629519540 0.71 C1(=CC=C(OC)C(OC)=C1OC)C(=O)CC(OCC)=O
MCULE-2973665670 0.71 C1(CCC(=O)C2C=C(OC)C(=C(OC)C=2)OC)C(OC)=CC(=CC=1O)OC
MCULE-1377941693 0.71 OC(C1CC2=C(C(=CC=C2)O)OC1)=O
MCULE-4950757386 0.71 CCCOC1=CC2=C(CC(C(O)=O)CO2)C=C1
MCULE-3631128471 0.71 COC1=CC2=C(CC(C(O)=O)CO2)C=C1
MCULE-2695022646 0.71 C1(CCC(=O)C2=CC=C(C(OC)=C2)OC)C(OC)=CC(=CC=1O)OC
MCULE-8939875451 0.71 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-4071615581 0.71 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-9337445879 0.71 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=C2C=CC=CC=12)OC)=O
MCULE-3613127722 0.71 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-8766238232 0.71 C12=C(OC)C=C(C=C1OC1(CC2=O)CCNCC1)OC
MCULE-1018595313 0.71 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-3625538935 0.71 C12C=C(OC)C=CC=1OC(CC2=O)C1=CC=CC=C1
MCULE-7439794905 0.71 C12C=C(OC)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MCULE-2731378392 0.71 O1CCCC(=O)C2=CC=C(O)C(C)=C12
MCULE-8525941266 0.71 C12C(=O)CCC1=CC(OC)=C(OC)C=2OC
MCULE-7060358452 0.71 COC1=C2C(C(CCCO2)=O)=CC=C1
MCULE-2097447105 0.71 C1(C(O)=CC2=C(CCC(C)(C)O2)C=1OC)C(=O)CC1=CC=C(OC)C=C1
MCULE-9748121668 0.71 O1C(C)C(C2C=CC3=C(C=2)OCCO3)C(C2C=C(CCC)C(OC)=CC1=2)=O
MCULE-5859909441 0.71 COC1=CC2=C(OCCC2=O)C=C1
MolPort-002-843-893 0.71 CC1(C)CC(=O)C2=C(O1)C1=CC=CC=C1C=C2
MolPort-035-705-961 0.71 COC1=C(O)C=C(C=C1O)[C@H]1OC2=CC(O)=CC=C2C(=O)[C@@H]1O
MolPort-002-834-812 0.71 COC1=CC(O)=C(CCC(=O)C2=CC(OC)=C(OC)C=C2)C(OC)=C1
MolPort-002-834-810 0.71 COC1=CC(O)=C(CCC(=O)C2=CC(OC)=C(OC)C(OC)=C2)C(OC)=C1
MolPort-002-472-237 0.71 OC(=O)C1COC2=C(O)C=CC=C2C1
MolPort-035-766-032 0.71 CCOC(=O)CC(=O)C1=C(OC)C(OC)=C(OC)C=C1
MolPort-009-560-828 0.71 COC1=CC=C2CC(COC2=C1)C(O)=O
MolPort-002-472-733 0.71 CCCOC1=CC=C2CC(COC2=C1)C(O)=O
MolPort-046-158-447 0.71 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-039-338-971 0.71 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-005-945-830 0.71 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-021-804-544 0.71 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-035-700-075 0.71 COC1=CC=C(C2CC(=O)OC3=CC=C4C(=O)CC(C)(C)OC4=C23)C2=CC=CC=C12
MolPort-039-338-896 0.71 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-046-596-314 0.71 COC1=CC2=C(O[C@@H](CC2=O)C2=CC=CC=C2)C=C1
MolPort-001-742-470 0.71 COC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
MolPort-002-904-882 0.71 COC1=C(OC)C(OC)=C2C(=O)CCC2=C1
MolPort-013-259-824 0.71 COC1=CC=CC2=C1OCCCC2=O
MolPort-035-873-801 0.71 COC1=C(O)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-004-955-567 0.71 COC1=CC2=C(OCCC2=O)C=C1
MolPort-002-499-601 0.71 CCC1(C)CC(=O)C2=CC=CC=C2O1
MolPort-000-693-538 0.70 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC=C(Br)C=C1)C=C2O
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-039-338-285 0.70 COC1=C(O)C=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C(CC=C(C)C)=C2O1
MolPort-000-659-576 0.70 CC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCCCO3)C=C2)C=C1
MolPort-035-874-008 0.70 CC(C)CC1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-008-468-723 0.70 Cl.COC1=CC2=C(C(=O)CC3(CCNCC3)O2)C(OC)=C1
MolPort-039-052-502 0.70 COC1=CC=C(C=C1)[C@H]1OC2=CC(OC)=CC(OC)=C2C(=O)[C@@H]1O
MolPort-009-108-510 0.70 CC1(C)CC(=O)C2=CC=C(OCCOC3=CC=C(F)C=C3)C=C2O1
MolPort-002-915-223 0.70 CCOC(=O)COC1=CC2=C(C=C1)C(=O)CC(C)(C)O2
MolPort-002-508-991 0.70 COC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCCO3)C=C2)C=C1
MolPort-002-718-925 0.70 OC1C(OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC(O)=C(O)C=C1
MolPort-006-069-341 0.70 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC(O)=C(O)C(O)=C1
MolPort-001-740-892 0.70 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-009-684-203 0.70 O[C@H]1[C@@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-003-850-396 0.70 O[C@@H]1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C(O)=C1
MolPort-001-740-800 0.70 OC1C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC(O)=C(O)C(O)=C1
MCULE-1528499595 0.70 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(O)C=1)OC)=O
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-9481971519 0.70 C1(C(CCC)=O)=CC=C(C=C1O)OCCCC
MCULE-8739063782 0.70 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-1040954793 0.70 O1C2C=CC=CC=2C(CC1C1C=CC=C(O)C=1)=O
MCULE-1545228810 0.70 C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MCULE-2735471310 0.70 Cl.C12=C(OC)C=C(C=C1OC1(CC2=O)CCNCC1)OC
MCULE-2349308709 0.70 CC1=CC2=C(OC(C3=CC4=C(OCCCCO4)C=C3)CC2=O)C=C1
MCULE-2827316384 0.70 C12OC3(CCCCC3)CC(=O)C1=CC=C1OC(=O)CC(CC(C)C)C=21
MCULE-3494790566 0.70 CC1(OC2=C(C=CC(=C2)OCCOC2=CC=C(F)C=C2)C(=O)C1)C
MCULE-5895803515 0.70 C1(C2=CC=CC=C2O)CC(C2C=C(O)C=CC=2O1)=O
MCULE-6464026618 0.70 C12C=CC(OCC(=O)OCC)=CC=1OC(CC2=O)(C)C
MCULE-2220805002 0.70 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCCO2)C=1
MCULE-2692728789 0.70 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2394173874 0.70 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2809167723 0.70 C12=C(O)C=C(C=C1OC(C(O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-4871721304 0.70 C12C(O)=CC(=CC=1O[C@H]([C@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2567986775 0.70 O1C2=CC(=CC(=C2C([C@H]([C@@H]1C1=CC=C(C(=C1)O)O)O)=O)O)O
MCULE-6698156528 0.70 O1C2=CC(=CC(=C2C([C@@H]([C@@H]1C1=CC(=C(C(=C1)O)O)O)O)=O)O)O
MCULE-2327386216 0.70 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
MCULE-4254870575 0.70 C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(O)C=1)O)O
MCULE-2296975795 0.70 C12=C(O)C=C(C=C1O[C@@H]([C@@H](O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-7840465084 0.70 C12OC(C)(C)CC(=O)C1=CC=C(OC)C=2O[Si](C)(C)C(C)(C)C
MCULE-4867351823 0.70 C12=CC=C(C=C1OCCC2=O)OCC1C=CC=CC=1
MCULE-2982479295 0.70 C1(O)C=C2OC[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MCULE-7842380240 0.70 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-3047713071 0.70 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 0.70 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 0.70 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 0.70 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 0.70 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-3177740984 0.70 C1(C(C2=CC=CC=C2O)C2C(=O)C3C=CC(=CC=3OC2=O)O)C(=O)C2C=CC(=CC=2OC1=O)O
MCULE-7927912257 0.70 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-6921330240 0.70 C(OC1C=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-3292535358 0.70 C12C=CC(OC)=CC=1OC[C@@H](C1=CC=C(OC)C=C1)C2=O
MCULE-2823268443 0.70 C1(=O)C(C2C=CC=CC=2)COC2C=C(OC)C=CC1=2
MCULE-5357027007 0.70 C1=C2OC(C3=CC=C(OC)C=C3)CC(=O)C2=CC=C1
MCULE-4344802390 0.70 CCCOC1=CC2=C(OCCC2=O)C=C1
MCULE-1191186137 0.70 CCOC1=CC2=C(OCCC2=O)C=C1
MCULE-3024245023 0.70 O1CC(C=O)CC2=CC=CC(OC)=C12
MCULE-9206985267 0.70 C12OC3(CCN(CC3)C(C)=O)CC(=O)C1=CC=C(O)C=2O
MCULE-4817576208 0.70 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 0.70 OC1C(O)=CC([C@@H]2OC3C(C([C@H]2O)=O)=C(O)C(C)=C(O)C=3)=CC=1O
MCULE-1338747805 0.70 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-6991857034 0.70 OC1C=CC([C@@H]2OC3=CC(O)=C(C)C(O)=C3C([C@H]2O)=O)=CC=1O
MCULE-4827438323 0.70 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1CC1C(O)=CC=CC=1
MCULE-1091199088 0.70 C1(C(CCC(O)=O)=O)=CC(OC)=C(C=C1OC)OC
MCULE-9959174498 0.70 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=C(OC)C2=C(OCCO2)C=1)=O
MolPort-039-338-897 0.70 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-046-693-674 0.70 COC1=CC=C(C=C1)[C@@H]1COC2=C(C=CC(OC)=C2)C1=O
MolPort-001-742-227 0.70 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-029-887-060 0.70 OC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)CO2
MolPort-002-508-671 0.70 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-042-675-535 0.70 OC1=CC=CC=C1CC1=C(O)C(CC2=CC=CC=C2O)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-039-338-900 0.70 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-039-338-901 0.70 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 0.70 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 0.70 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-045-901-612 0.70 COC1=CC2=C(C=C1)C(=O)C(CO2)C1=CC=CC=C1
MolPort-046-158-526 0.70 COC1=C2C(=O)[C@H](O)[C@H](OC2=CC(O)=C1)C1=CC=CC=C1
MolPort-001-513-154 0.70 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC=C2
MolPort-009-044-131 0.70 CCCOC1=CC=C2OCCC(=O)C2=C1
MolPort-016-634-068 0.70 CCOC1=CC2=C(OCCC2=O)C=C1
MolPort-039-141-839 0.70 CC1=C(O)C2=C(O[C@@H]([C@@H](O)C2=O)C2=CC(O)=C(O)C(O)=C2)C=C1O
MolPort-039-141-838 0.70 CC1=C(O)C2=C(O[C@@H]([C@@H](O)C2=O)C2=CC(O)=C(O)C=C2)C=C1O
MolPort-005-944-657 0.70 CC1=C(O)C=C2O[C@H]([C@H](O)C(=O)C2=C1O)C1=CC(O)=C(O)C(O)=C1
MolPort-000-844-458 0.70 CC(=O)N1CCC2(CC1)CC(=O)C1=C(O2)C(O)=C(O)C=C1
MolPort-005-945-431 0.70 CC1=C(O)C=C2O[C@H]([C@H](O)C(=O)C2=C1O)C1=CC(O)=C(O)C=C1
MolPort-042-675-534 0.70 OC1=CC=CC=C1CC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-924-576 0.70 COC1=CC(OC)=C(C=C1OC)C(=O)CCC(O)=O
MolPort-009-216-878 0.70 COC1=CC=C(C=C1OC)C(C1C(=O)OC2=CC=CC=C2C1=O)C1C(=O)OC2=CC=CC=C2C1=O
MolPort-035-701-412 0.70 COC1=CC(=CC2=C1OCCO2)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-000-154-681 0.69 COC(=O)CC(=O)C1=CC=C(OC)C=C1OC
MolPort-000-218-768 0.69 COC1=CC2=C(OC(CC2=O)C2=CC=C(C)C=C2)C=C1
MolPort-046-202-610 0.69 O=C1C2CC2OC2=C1C=CC=C2
MolPort-035-874-004 0.69 COC1=CC(=CC(OC)=C1O)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-873-411 0.69 COC1=C(O)C=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-700-574 0.69 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC5=C(OCO5)C=C4)C3=C2O1
MolPort-001-740-729 0.69 COC1=CC(O)=C2C(=O)[C@H](O)[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-008-610-236 0.69 COC1=C(OC)C(OC)=C(C=C1)C(=O)CCC(O)=O
MolPort-029-759-368 0.69 CC1(C)COC2=C(C=CC=C2)C1=O
MolPort-003-665-793 0.69 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC(O)=C(O)C(O)=C1
MolPort-020-364-972 0.69 CC1COC2=CC=CC=C2C1=O
MolPort-006-069-167 0.69 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC(O)=C(O)C=C1
MolPort-002-927-301 0.69 COC1=CC=C(CCC(=O)C2=C(OC)C=C(OC)C=C2)C=C1
MolPort-000-165-369 0.69 COC1=CC(OC)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1
MolPort-006-318-926 0.69 CC1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-042-623-389 0.69 CC1CCC2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-042-623-374 0.69 CC(C)(C)C1CCC2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-003-757-733 0.69 CC(C)(C)C1CC[C@@]2(CC1)CC(=O)C1=C(O2)C=C(OCC(O)=O)C=C1
MolPort-000-850-878 0.69 OC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-001-814-284 0.69 COC1=CC2=C(C(=O)CC2)C(OC)=C1
MolPort-003-762-865 0.69 COC1=CC2=C(C=C1)C(=O)CC1(CCNCC1)O2
MolPort-042-675-533 0.69 OC1=CC=CC=C1CC1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC=CC=C1
MolPort-035-873-377 0.69 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MCULE-5458695470 0.69 C1(C=CC(=CC=1OC)OC)C(=O)CC(OC)=O
MCULE-2979677001 0.69 C12=CC(OC)=CC=C1OC(CC2=O)C1C=CC(=CC=1)C
MCULE-8070790682 0.69 C12OC(CC(=O)C=1C=C(C(OCC1C=CC(N(=O)=O)=CC=1)=C2)OCC1=CC=C(N(=O)=O)C=C1)(C)C
MCULE-2739140364 0.69 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC2=C(OCO2)C=1)=O
MCULE-9499751546 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1)O)=O
MCULE-4642760159 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1=CC(OC)=C(C(OC)=C1)O)=O
MCULE-1391160859 0.69 COC1=C(OC)C(OC)=C(C(CCC(O)=O)=O)C=C1
MCULE-3159000697 0.69 C1(OC)C=C2O[C@@H]([C@@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MCULE-2331262877 0.69 C1(COC2=C(C=CC(OC)=C2)C1=O)C1C(OC)=CC(=C(OC)C=1OC)OC
MCULE-7478537845 0.69 C1(C(=O)CCC2C=CC(OC)=CC=2)=CC=C(OC)C=C1OC
MCULE-1171828876 0.69 C1(C(=O)CCC2C=CC(OC)=CC=2)=C(O)C=C(OC)C=C1OC
MCULE-8371282223 0.69 C1(=CC=C(C=C1OC)OC)C(CCC1=CC=CC=C1)=O
MCULE-9634821184 0.69 O1C2C=C(O)C=CC=2C([C@H](O)[C@H]1C1=CC(O)=C(C(O)=C1)O)=O
MCULE-3231582881 0.69 [C@H]1([C@@H](O)C(C2C=CC(O)=CC=2O1)=O)C1C=CC(O)=C(O)C=1
MCULE-5340165807 0.69 C1(O)C=C2OC(C(C(=O)C2=CC=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-5665116242 0.69 C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MCULE-7474710506 0.69 C12C=C(C=CC=1C(CC1(CCC(CC1)C(C)(C)C)O2)=O)OCC(O)=O
MCULE-7338372949 0.69 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(O)=O
MCULE-7523413286 0.69 C12=CC(=CC=C1C(CC1(CCC(CC1)C)O2)=O)OCC(O)=O
MCULE-8425993159 0.69 O=C1CCC2=C1C(OC)=CC(OC)=C2
MCULE-5696093381 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-4375575651 0.69 C12=CC(OC)=CC=C1C(CC1(CCNCC1)O2)=O
MCULE-6668187578 0.69 C(C1C(O)=CC(O)=C2C=1O[C@H](C1C=CC=CC=1)CC2=O)C1=C(O)C=CC=C1
MCULE-6647372730 0.69 C(=C(/C)\C)\CC1C(=C2C(OC(C)C(C)C2=O)=C(C(CC(=O)O)CCC)C=1OC)O
MCULE-6331583005 0.69 O1C(C2C=CC(=CC=2)O)CC(C2C=CC=CC=21)=O
MCULE-9221415167 0.69 C1(C)(C)CC(C2=CC(=C(O)C=C2O1)Cl)=O
MCULE-2844946240 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC=C(O)C=1)=O
MCULE-7249832807 0.69 CC1=CC2=C(OCCC2=O)C(C)=C1
MCULE-6097982009 0.69 C(C1=CC=C(O)C=C1O)(=O)CCC1=CC=C(OC)C(C)=C1OC
MCULE-5785195808 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1)OC)=O
MCULE-8782646633 0.69 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O
MCULE-7064559962 0.69 C1(O)C=C2OC(O)(C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-5783041391 0.69 OC(C1CC2=C(C=C(C=C2)O)OC1)=O
MCULE-6730529909 0.69 C12OCCCCOC1=CC=C(C(CCC1=CC=CC=C1)=O)C=2
MCULE-2108662486 0.69 C12OC3C(C)(C)C3C1=C1OC(C3C=CC=CC=3)CC(C1=C(OC)C=2)=O
MCULE-3341716045 0.69 C1(OC)C=C2OC(O)[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MolPort-004-960-064 0.69 OC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=CC=C2
MolPort-021-804-590 0.69 CCCC(CC(O)=O)C1=C(OC)C(CC=C(C)C)=C(O)C2=C1OC(C)C(C)C2=O
MolPort-038-942-141 0.69 OC1=CC=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-002-910-536 0.69 CC1(C)CC(=O)C2=C(O1)C=C(O)C(Cl)=C2
MolPort-035-873-637 0.69 OC1=CC=CC(=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-008-645-059 0.69 CC1=CC2=C(OCCC2=O)C(C)=C1
MolPort-035-873-601 0.69 COC1=C(OC)C=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-873-176 0.69 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-000-165-371 0.69 COC1=C(OC)C(O)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1
MolPort-005-945-868 0.69 CC(C)=CCOC1=CC=C(C=C1)C1CC(=O)C2=CC=C(O)C=C2O1
MolPort-004-289-999 0.69 OC(=O)C1COC2=CC(O)=CC=C2C1
MolPort-035-683-180 0.69 OC1=CC=C(C=C1)C1(O)CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-039-063-553 0.69 CC1CC(=O)C2=C(C)C=CC=C2O1
MolPort-019-937-108 0.69 COC1=C2C(=O)CC(OC2=C2C3C(OC2=C1)C3(C)C)C1=CC=CC=C1
MolPort-035-705-986 0.69 COC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)C(O)O2
MolPort-000-693-541 0.68 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1)C=C2O
MolPort-026-950-276 0.68 CC(=O)C1COC2=CC=CC=C2C1
MolPort-002-509-149 0.68 COC1=CC(OC)=C(CCC(=O)C2=C(OC)C=C(OC)C=C2)C=C1
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-002-834-807 0.68 COC1=CC(OC)=C(C=C1)C(=O)CCC1=C(O)C=CC=C1
MolPort-046-763-070 0.68 CCC(=O)C1=C(O)C(O)=C(OC)C=C1OC
MolPort-008-640-980 0.68 Cl.COC1=CC2=C(C=C1)C(=O)CC1(CCNCC1)O2
MolPort-000-648-971 0.68 CC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCCO3)C=C2)C=C1
MolPort-023-187-072 0.68 O=C1CC2(CCC2)OC2=CC=CC=C12
MolPort-001-741-320 0.68 COC1=CC(=CC=C1O)C1CC(=O)C2=C(O)C(CC=C(C)C)=C(O)C=C2O1
MolPort-013-259-820 0.68 COC1=CC2=C(OCCCC2=O)C=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-002-893-161 0.68 CCCC1=C(O)C=CC2=C1OC(C)(CCC(=O)OC)CC2=O
MolPort-001-741-626 0.68 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=CC=C1
MolPort-046-508-982 0.68 COC1=C(O)C=CC(C2COC3=CC(O)=CC(O)=C3C2=O)=C1OC
MolPort-003-761-510 0.68 CCC1=CC=C(OCCC(=O)C2=C(O)C=C(O)C=C2)C=C1
MolPort-000-659-530 0.68 COC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCO3)C=C2)C=C1
MolPort-023-275-753 0.68 COC1=CC(OC)=C2C(=O)C[C@H](OC2=C1CC=C(C)C)C1=CC=CC=C1
MolPort-039-339-032 0.68 COC1=C2C(=O)C[C@H](OC2=C(CC=C(C)C)C(O)=C1)C1=CC=C(O)C=C1
MolPort-039-337-096 0.68 COC1=CC(O)=C(CC=C(C)C)C2=C1C(=O)CC(O2)C1=CC=C(O)C=C1
MolPort-002-345-103 0.68 OCC1(CO)COC2=C(C=CC=C2)C1=O
MolPort-028-803-024 0.68 COC1=CC(C(C)=O)=C(OC)C=C1OC1CCCC1
MolPort-001-815-132 0.68 COC1=CC2=C(CCC2=O)C(OC)=C1OC
MolPort-002-023-364 0.68 COC1=C2OCC(CC2=CC=C1)C(O)=O
MolPort-046-202-547 0.68 O=C1[C@@H]2CC[C@@H]2OC2=C1C=CC=C2
MolPort-009-014-374 0.68 O=C(CCC1=CC=CC=C1)C1=CC=C2OCCCCCOC2=C1
MCULE-8498305648 0.68 C1(C=CC(=CC=1OC)OC)C(=O)CCC1=CC=C(C=C1OC)OC
MCULE-8095520519 0.68 C1(C=CC(=CC=1OC)OC)C(=O)CCC1C=CC=CC=1O
MCULE-6715037033 0.68 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=CC=1)C1C=CC=CC=1
MCULE-1097395119 0.68 C1C=C2C(OC(CC2=O)C2C=CC(C3C=CC=CC=3)=CC=2)=CC=1O
MCULE-6959312962 0.68 Cl.C12=CC(OC)=CC=C1C(CC1(CCNCC1)O2)=O
MCULE-1354717254 0.68 C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCCO2)=C1
MCULE-5696384668 0.68 O=C1C2=C(C=CC=C2)OC2(CCC2)C1
MCULE-5932994358 0.68 COC1=CC2=C(OCCCC2=O)C=C1
MCULE-1746821853 0.68 C1(C(CCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-8193782270 0.68 C1(C(CCCCCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-4773129937 0.68 C1(OC(C)=O)=CC(=CC=C1C(CCC1C=CC=CC=1)=O)OC(C)=O
MCULE-2163904316 0.68 C1(O)C=C2C(C(CC(C3=CC(OC)=C(O)C=C3)O2)=O)=C(C=1C/C=C(\C)/C)O
MCULE-7240659397 0.68 C1=C(OC)C(=CC(C(=O)CCCCC(=O)O)=C1OC)OC
MCULE-2776613173 0.68 C12C=CC(C)=CC=1C(=O)CC(C1C=CC=CC=1)O2
MCULE-6005797708 0.68 C1=C(C(=CC(C(=O)CCCCCCC(=O)O)=C1OC)OC)OC
MCULE-4861196207 0.68 [C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@H]1C
MCULE-9256304709 0.68 C1=C(C(=CC(C(=O)CCCCCC(=O)O)=C1OC)OC)OC
MCULE-1834901303 0.68 C12=CC(OCCN3CCOCC3)=CC=C1C(CC(C)(C)O2)=O
MCULE-6303182626 0.68 C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(F)=CC=1
MCULE-1723755110 0.68 C12OC(CC(=O)C1=CC=C(O)C=2CCC)(C)CCC(=O)OC
MCULE-4463093454 0.68 C12C(O)=CC(O)=CC=1O[C@H](C1C=CC=CC=1)[C@@H](O)C2=O
MCULE-6373579877 0.68 C1(O)C=C2OCC(C3C=CC(O)=C(OC)C=3OC)C(=O)C2=C(O)C=1
MCULE-4560358638 0.68 C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-1001006382 0.68 C1(=CC=C(C=C1O)O)C(CCOC1C=CC(=CC=1)CC)=O
MCULE-4917078155 0.68 O1COC2C=C3C(C4C=C(OC)C(OC)=C(OC)C=4)C(C(C)(O)OC3=CC1=2)C(C)=O
MCULE-6345475038 0.68 C1(=O)C2C=CC=CC=2OCC1(CO)CO
MCULE-1825001608 0.68 C1(O)C(C/C=C(/C)\C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-9052045784 0.68 C1(OC)C(C/C=C(\C)/C)=C2C(C(=O)C[C@H](O2)C2C=CC=CC=2)=C(C=1)OC
MCULE-5729797705 0.68 C12OC(CC(=O)C=1C(OC)=CC(O)=C2C/C=C(\C)/C)C1C=CC(O)=CC=1
MCULE-9480249121 0.68 C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCO2)C=1
MCULE-8365920104 0.68 COC1C=C2C(CCC2=O)=C(OC)C=1OC
MCULE-8964231123 0.68 COC1=C(OC2CCCC2)C=C(OC)C(C(C)=O)=C1
MCULE-8112601720 0.68 COC1=C2C(CC(C(O)=O)CO2)=CC=C1
MCULE-1014358885 0.68 C12OCCCCCOC=1C=CC(C(=O)CCC1C=CC=CC=1)=C2
MCULE-4703496504 0.68 C1(OC)=C(OC)C=CC(C(=O)CCCCC(=O)O)=C1OC
MCULE-5855528622 0.68 C1(O)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-3967893054 0.68 C1(OC)=C(C=CC(C(=O)CCCCCC(=O)O)=C1OC)OC
MCULE-7729342140 0.68 C1C=C(C(=O)C2C3OC(C)(C)CCC=3C(O)=CC=2O)C=CC=1
MCULE-7295229373 0.68 C1(OC)=C(C=CC(C(=O)CCCCCCC(=O)O)=C1OC)OC
MCULE-6734766646 0.68 C(OC1C=C2C(=CC=1C)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-4397917979 0.68 C(OC1C(C)=C2C(=CC=1)C(=O)CCCO2)(=O)C(C)(C)C
MCULE-8678278778 0.68 C1(=CC(=CC=C1OC)CC1COC2C(=CC=CC=2OC)C1)C(N)=O
MCULE-1758396763 0.68 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)NC(C)C
MCULE-7135363751 0.68 C12C(=O)CC(OC1=CC(=C(CN(C)C)C=2O)OC)(C)C
MCULE-2325690490 0.68 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)OCC(C)=C)=O
MCULE-3983609593 0.68 C1(=CC=C(C=C1OC)OC)C(=O)CC(=O)C1C=CC(=CC=1OC)OC
MCULE-3241722945 0.68 C1C=C2C(C(=O)CCO2)=CC=1C
MCULE-7320172868 0.68 C12C(=CC=CC=1OCC(C(O)=O)C2)OC
MCULE-5495431317 0.68 C1(C(C)=O)=CC(CCCCCC)=C(C=C1O)OCCCC
MCULE-4267260797 0.68 C12=CC(OC)=CC=C1CC(CO2)CC1=CC=C(C=C1)C(N)=O
MCULE-3925941144 0.68 O1C(C2C=CC=CC=2)CC(C2C=CC=CC=21)=O
MCULE-8876698541 0.68 C1C=C2C(=CC=1)C(=O)C[C@@H](C1C=CC=CC=1)O2
MCULE-3448023971 0.68 C1=C(OC)C(=CC(C(=O)CCCC(=O)O)=C1OC)OC
MCULE-2575175530 0.68 C1(O)C=C2OCC(C3C(OC)=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-8135607815 0.68 CC1(OC2=C(C=CC(=C2)OCC2=CC=C(C(N)=O)C=C2)C(=O)C1)C
MCULE-3029164834 0.68 C1(O)C=C2O[C@H]([C@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MCULE-8960596008 0.68 C12OC(CC(=O)C=1C(C)=CC(OCC1C=C(C=CC=1C)C)=C2)(C)C
MCULE-6429597192 0.68 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6744641772 0.68 C12C=CC(=C(C)C=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-5733387532 0.68 C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-9298140592 0.68 O1C2C=CC=CC=2C(C[C@]1([H])C1=CC=C2C(OCCO2)=C1)=O
MolPort-003-846-731 0.68 OC1=CC=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O
MolPort-023-298-963 0.68 CC1(C)CCC2=C(O)C=C(O)C(C(=O)C3=CC=CC=C3)=C2O1
MolPort-006-319-012 0.68 COC1=C(CN(C)C)C(O)=C2C(=O)CC(C)(C)OC2=C1
MolPort-000-853-573 0.68 CC(C)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-028-731-897 0.68 COC1=C2OCC(CC3=CC(C(N)=O)=C(OC)C=C3)CC2=CC=C1
MolPort-035-701-517 0.68 CC(=C)COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-000-891-044 0.68 COC1=CC(OC)=C(C=C1)C(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-022-383-382 0.68 COC1=CC=CC2=C1CC(CO2)C(O)=O
MolPort-001-793-702 0.68 CC1=CC2=C(OCCC2=O)C=C1
MolPort-027-867-828 0.68 COC1=CC2=C(CC(CC3=CC=C(C=C3)C(N)=O)CO2)C=C1
MolPort-000-696-915 0.68 O=C1CC(OC2=C1C=CC=C2)C1=CC=CC=C1
MolPort-027-700-530 0.68 CC1(C)CC(=O)C2=CC=C(OCC3=CC=C(C=C3)C(N)=O)C=C2O1
MolPort-039-142-054 0.68 COC1=CC(OC)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-001-842-611 0.68 CC1=CC(COC2=CC3=C(C(=O)CC(C)(C)O3)C(C)=C2)=C(C)C=C1
MolPort-016-638-406 0.68 O[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-001-741-294 0.68 O[C@H]1[C@@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MolPort-002-510-392 0.68 O=C1C[C@@H](OC2=C1C=CC=C2)C1=CC2=C(OCCO2)C=C1
MolPort-039-338-397 0.68 COC1=C(C)C(O)=C2C(=O)[C@H](O)[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-028-913-018 0.67 COC1=C(OC)C2=C(C=C1)C(=O)CC(C)(CCC(=O)N1CCCC1)O2
MolPort-008-646-899 0.67 CC(C)C1=CC=C2OCCC(=O)C2=C1
MolPort-008-645-056 0.67 CCC1=CC2=C(OCCC2=O)C=C1
MolPort-003-762-423 0.67 O=C(C1CC2=C(OC1=O)C=CC1=CC=CC=C21)C1=CC=CC=C1
MolPort-002-472-269 0.67 CCOC1=C2OCC(CC2=CC=C1)C(O)=O
MolPort-020-167-517 0.67 CC1=CC2=C(C=C1C)C(=O)CCO2
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-005-909-403 0.67 COC(=O)COC1=CC2=C(C=C1)C(=O)CC1(CCCCC1)O2
MolPort-035-701-388 0.67 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC=C(C=C4)C(O)=O)C3=C2O1
MolPort-002-153-193 0.67 COC1=CC=C2C(=O)CC(O)(OC2=C1)C(F)F
MolPort-029-936-323 0.67 CC(C)(C)C(=O)N1CCC(COC2=CC=C3C(=O)CC(C)(C)OC3=C2)CC1
MolPort-002-846-527 0.67 CC1(C)CCC2=C3OC(C)(C)CCC3=CC=C2O1
MolPort-001-762-318 0.67 O=C1CCOC2=CC=CC=C12
MolPort-003-803-650 0.67 COC1=C(C=CC(O)=C1)C(=O)CCC1=CC=C(O)C=C1
MolPort-044-754-120 0.67 OC1=CC=C(CC2COC3=CC(O)=CC=C3C2)C=C1
MCULE-1480851535 0.67 C12OC(C)(CCC(=O)N3CCCC3)CC(=O)C1=CC=C(OC)C=2OC
MCULE-2276070011 0.67 C1OC2=C(C=C(CC)C=C2)C(=O)C1
MCULE-4246483525 0.67 C12=CC(OC)=CC=C1OCC(C=O)C2
MCULE-9679610001 0.67 CC(C1=CC2=C(OCCC2=O)C=C1)C
MCULE-1069224262 0.67 O=C1C2C(=CC=C(C=2)C(C)(C)C)OCC1
MCULE-8045809230 0.67 CC1=C(C)C=C2C(OCCC2=O)=C1
MCULE-3831207387 0.67 CCOC1=C2C(CC(C(O)=O)CO2)=CC=C1
MCULE-3084067707 0.67 C1(CC2=C3C=CC=CC3=CC=C2OC1=O)C(C1C=CC=CC=1)=O
MCULE-9967583462 0.67 C1(OC)=C(OC)C=CC(C(=O)CCCC(=O)O)=C1OC
MCULE-9773979294 0.67 C1(O)(CC(=O)C2C(=CC(=CC=2)OC)O1)C(F)(F)F
MCULE-2241769755 0.67 CC(C(N1CCC(COC2=CC3=C(C(CC(O3)(C)C)=O)C=C2)CC1)=O)(C)C
MCULE-5596378261 0.67 C12C=C(C=CC=1C(CC1(CCCCC1)O2)=O)OCC(OC)=O
MCULE-1326957022 0.67 C1(O)(C(F)F)CC(=O)C2C(=CC(=CC=2)OC)O1
MCULE-7526645898 0.67 C1(CC(C2C=C(OC)C=CC=2O1)=O)C1C=CC=C(OC)C=1OC
MCULE-8848992989 0.67 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(O)=O)=O
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-5039398124 0.67 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)CC2=CC=1
MCULE-9773382618 0.67 C1(=CC=C(C=C1OC)O)C(CCC1=CC=C(O)C=C1)=O
MCULE-6543223040 0.67 C12C=CC=CC=1OCCC2=O
MCULE-1692843751 0.67 C12CCC(OC=1C=CC1CCC(C)(C)OC2=1)(C)C
MCULE-4031084353 0.67 C1(=CC=C(C=C1O)OC)C(=O)CC(=O)C1=CC=C(C(OC)=C1)OC
MCULE-6986999929 0.67 C1(=CC=C(C(OCCC)=C1)OCCC)C(CCC1C=CC=CC=1)=O
MCULE-8367548119 0.67 C1(=O)CC2(CCCCCCCCCCC2)OC2C=CC=CC1=2
MCULE-5075432556 0.67 O=C1C2=C(C=CC=C2)OC2(CCCC2)C1
MCULE-1405836247 0.67 C1(O)C=C2OCC(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-1477744891 0.67 C12C=CC(OCC3C=CC=CC=3F)=CC=1OC(CC2=O)(C)C
MCULE-3016034856 0.67 C12=CC(=CC=C1C(CC(C)(C)O2)=O)OCC1C=CC=CC=1Cl
MCULE-9361233668 0.67 C12OC(CC(=O)C=1C=CC(OCC1=CC=CC(F)=C1)=C2)(C)C
MCULE-4396859889 0.67 C12C(=O)CC(C)(C)OC=1C=C(C=C2C)OCC1C=CC(Br)=CC=1
MCULE-4719487645 0.67 C12C=C(CC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-4102972705 0.67 C12C3C=CC=CC=3C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MCULE-9948220621 0.67 C12C=C(CCC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-3563693636 0.67 C1OC2=C(C=CC(O)=C2C)C(=O)C1C1=CC=C(O)C=C1
MCULE-8346190960 0.67 COC1=C(OC)C(OC)=CC(CCC(OC2=CC=C(C(C)=O)C=C2)=O)=C1
MCULE-1369586422 0.67 C1=C(OC)C=CC(C(=O)CC(=O)C)=C1OC
MCULE-3956882637 0.67 C1(CC(=O)C2=C(C=CC=C2)O1)C1C=CC=C(OC)C=1OC
MCULE-9182612724 0.67 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=CC=1
MCULE-5605893366 0.67 CC1=C(C)C2=C(OCCC2=O)C=C1
MCULE-6501771066 0.67 C1(C(CCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-3384286474 0.67 C1(C(CCCCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-5292719812 0.67 C1=C(C(OC)=CC(=C1OC)C(=O)CCC(=O)OCC)OC
MCULE-6122035709 0.67 C12C(=O)CC(C)(C)OC=1C(C)=C(C=C2)OCC1=CC=CC(OC(F)(F)F)=C1
MCULE-2643594080 0.67 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@@H](C)CO
MCULE-3239542040 0.67 C12=CC=CC(C)=C1OCCC2=O
MCULE-5610620315 0.67 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCC
MCULE-7928773502 0.67 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC(OC)=C2C(OCO2)=C1)=O
MCULE-1689119297 0.67 C1(C(CCC)=O)=CC=C(C=C1O)OCCCCCCC
MCULE-9223749209 0.67 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-9467611202 0.67 C1(C=CC(=C(OC)C=1)OC)C(CCOC1=CC=C(C=C1)OC)=O
MCULE-5559057559 0.67 C1(O)C=C2O[C@H]([C@@H](C(C2=CC=1)=O)O)C1C=CC(O)=CC=1
MCULE-1688334671 0.67 CCOC(CC(C1C=CC(OC)=CC=1OC)=O)=O
MCULE-3308274010 0.67 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCCO)=O
MCULE-1428739399 0.67 O=C(OC)C1CC2C=CC=C(OC)C=2OC1
MCULE-7969907096 0.67 C12=CC(OCCN3CCCCC3)=CC=C1C(CC(C)(C)O2)=O
MCULE-1427011280 0.67 C1C=C(C(=O)C2C(O)=C3CCC(C)(C)OC3=CC=2O)C=CC=1
MolPort-039-141-920 0.67 OC1=CC(O)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-002-251-365 0.67 COC1=CC(O)=C(C=C1)C(=O)CC(=O)C1=CC(OC)=C(OC)C=C1
MolPort-001-004-400 0.67 CCCOC1=C(OCCC)C=C(C=C1)C(=O)CCC1=CC=CC=C1
MolPort-001-017-668 0.67 O=C1CC2(CCCCCCCCCCC2)OC2=C1C=CC=C2
MolPort-006-417-708 0.67 O=C1CC2(CCCC2)OC2=CC=CC=C12
MolPort-000-657-221 0.67 CCCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-002-511-184 0.67 O=C1CC(OC2=C1C=CC1=CC=CC=C21)C1=CC2=C(OCCO2)C=C1
MolPort-002-915-225 0.67 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=C(F)C=CC=C1)C=C2
MolPort-002-915-226 0.67 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC(F)=CC=C1)C=C2
MolPort-002-509-337 0.67 CCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-002-915-231 0.67 CC1=CC(OCC2=CC=C(Br)C=C2)=CC2=C1C(=O)CC(C)(C)O2
MolPort-039-142-001 0.67 O[C@@H]1[C@H](OC2=C(C=CC(O)=C2)C1=O)C1=CC=C(O)C=C1
MolPort-002-511-595 0.67 COC1=CC=C(OCCC(=O)C2=CC(OC)=C(OC)C=C2)C=C1
MolPort-001-842-620 0.67 CC1=C(OCC2=CC=CC(OC(F)(F)F)=C2)C=CC2=C1OC(C)(C)CC2=O
MolPort-003-658-887 0.67 COC1=CC(OC)=C(C=C1)C(=O)CC(C)=O
MolPort-020-093-193 0.67 CC1=CC=C2OCCC(=O)C2=C1C
MolPort-008-644-206 0.67 CC1=CC=CC2=C1OCCC2=O
MolPort-035-701-265 0.67 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-005-924-596 0.67 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCCO)C=C2O
MolPort-000-154-677 0.67 CCOC(=O)CC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-035-772-656 0.67 Cl.OC1=CC=C2C(=O)CC3(CCNCC3)OC2=C1
MolPort-002-131-116 0.67 CCCCCCCOC1=CC(O)=C(C=C1)C(=O)CCC
MolPort-005-945-530 0.67 O[C@H]1[C@@H](OC2=CC(O)=CC=C2C1=O)C1=CC=C(O)C=C1
MolPort-005-787-534 0.67 COC1=CC(CCC(=O)OC2=CC=C(C=C2)C(C)=O)=CC(OC)=C1OC
MolPort-039-055-793 0.67 C[C@@H](CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-023-298-962 0.67 CC1(C)CCC2=C(O)C(C(=O)C3=CC=CC=C3)=C(O)C=C2O1
MolPort-002-536-086 0.67 CC(C)(CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-035-700-180 0.67 COC1=CC(=CC2=C1OCO2)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-002-509-154 0.66 CC1=CC2=C(C=C1)C(=O)CC(O2)C1=CC2=C(OCCO2)C=C1
MolPort-039-339-001 0.66 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-000-659-529 0.66 CC1=CC2=C(OC(CC2=O)C2=CC3=C(OCCO3)C=C2)C=C1
MolPort-005-945-639 0.66 COC1=CC(=CC(CC=C(C)C)=C1O)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-035-705-948 0.66 COC1=C(O)C=C(CC2(O)OC3=C(C2=O)C(O)=CC(O)=C3)C=C1O
MolPort-006-417-709 0.66 O=C1CC2(CCCCC2)OC2=CC=CC=C12
MolPort-012-466-540 0.66 CCOC(=O)CCC(=O)C1=C(OC)C(OC)=C(OC)C=C1
MolPort-002-534-970 0.66 CC(C)CNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-008-442-022 0.66 CC1(C)CC(=O)C2=C(O1)C=CC(=C2)C(O)=O
MolPort-000-847-603 0.66 CCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-007-673-735 0.66 CC1(CC(=O)C2=CC(O)=CC=C2O1)C1=CC=C(F)C=C1
MolPort-007-673-726 0.66 CC1(CC(=O)C2=CC(O)=CC=C2O1)C1=CC=C(Cl)C=C1
MolPort-005-306-421 0.66 COC1=C(CCC(O)=O)C=C2OCCCOC2=C1
MolPort-002-819-134 0.66 O=C1CC(OC2=C1C=CC=C2)C1CCCCC1
MolPort-002-800-144 0.66 CC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=CC=C2
MolPort-035-701-796 0.66 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-046-591-140 0.66 OC1CC(=O)C2=C(O1)C=C(OCCCCl)C=C2
MolPort-000-847-591 0.66 CCC(C)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-020-005-754 0.66 COC1=CC(OC)=C(CCC(=O)C2=CC=C(O)C=C2)C(OC)=C1
MolPort-020-005-759 0.66 COC1=CC=C(CCC(=O)C2=CC=C(O)C=C2)C(OC)=C1
MolPort-008-645-058 0.66 CC1=C(C)C2=C(C=C1)C(=O)CCO2
MolPort-028-738-297 0.66 COC1=CC=CC2=C1OCC(CC1=CC(O)=CC=C1)C2
MolPort-005-957-922 0.66 CCOC1=CC(OCC)=C(C=C1)C(=O)CC
MolPort-000-875-091 0.66 O=C1CCOC2=C1C1=CC=CC=C1C=C2
MolPort-002-915-233 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC1=CC=C(C=C1)[N+]([O-])=O)C(OCC1=CC=C(C=C1)[N+]([O-])=O)=C2
MolPort-035-873-875 0.66 OC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-001-742-622 0.66 COC1=CC=C(C=C1)C1CC(=O)C2=C(O)C(CC=C(C)C)=C(O)C=C2O1
MolPort-035-701-832 0.66 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=C(OCC(O)=O)C=CC=C4)C3=C2O1
MolPort-002-511-009 0.66 CC(C)=CCC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-742-504 0.66 CC(C)=CCC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-035-873-207 0.66 COC1=C(C=CC=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-035-873-741 0.66 COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-001-842-614 0.66 CC1=C(OCC2=C(F)C=CC=C2)C=CC2=C1OC(C)(C)CC2=O
MolPort-020-039-853 0.66 CCOC1=CC=CC2=C1OCC(C2)C(=O)OC
MolPort-022-417-411 0.66 CC1(C)CC(=O)C2=C(O1)C=C(Br)C=C2
MCULE-3316368164 0.66 C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCO2)=C1
MCULE-7018809823 0.66 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-5780294009 0.66 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=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-2538844083 0.66 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(OC)=C(O)C=1
MCULE-2163764809 0.66 C1(C)(C2C=CC(=CC=2)Cl)CC(=O)C2C(=CC=C(O)C=2)O1
MCULE-3425990668 0.66 C1(C)(C2C=CC(=CC=2)F)CC(=O)C2C(=CC=C(O)C=2)O1
MCULE-1096692232 0.66 C12C(CCOC1=C(C=C(C(O)=O)C=2)OC)=O
MCULE-4229645908 0.66 C1(OC)=C(C=CC(=C1OC)C(=O)CCC(=O)OCC)OC
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-1891088273 0.66 C1=C(OC)C(=CC2OCCCOC1=2)CCC(O)=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-3027926421 0.66 O1CC(CC2C=CC=C(O)C=2)CC2=CC=CC(OC)=C12
MCULE-8124496200 0.66 C1(O)C=CC(C(=O)CCC2C=CC(OC)=CC=2OC)=CC=1
MCULE-2544456104 0.66 C1(C(CC)=O)=CC=C(C=C1OCC)OCC
MCULE-9068708096 0.66 C1(O)C=CC(C(CCC2C(OC)=CC(OC)=CC=2OC)=O)=CC=1
MCULE-4595357464 0.66 C12=C(C=CC3C=CC=CC1=3)OCCC2=O
MCULE-3804005859 0.66 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC=CC=1OC)=O
MCULE-3643867192 0.66 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=CC=1)OC)=O
MCULE-7172712096 0.66 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC(=CC=1)O)=O
MCULE-7823125252 0.66 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC=CC=1OCC(O)=O)=O
MCULE-1448234011 0.66 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-1883133712 0.66 C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1C=CC=CC=1
MCULE-7506688119 0.66 C12C(=O)CC(OC1=CC(=C(C/C=C(/C)\C)C=2O)O)C1=CC=C(C=C1)OC
MCULE-8750784705 0.66 C12C(=O)C[C@H](OC=1C=C(C(C/C=C(/C)\C)=C2O)O)C1C=CC=CC=1
MCULE-1088177999 0.66 C12OC(CC(=O)C=1C=CC(OCC1C=CC=CC=1F)=C2C)(C)C
MCULE-7588457893 0.66 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)N(=O)=O
MCULE-9833779748 0.66 C1=C(C(=CC(C(=O)CCCCCC(=O)OCC)=C1OC)OC)OC
MCULE-2885326245 0.66 O=C1C2=CC3CCOC=3C=C2OCCC1
MCULE-9192857315 0.66 C1=C(C(=CC(=C1OC)C(=O)CCCCC(=O)OCC)OC)OC
MCULE-7722453259 0.66 C1=C(OC)C(OC)=CC(C(=O)CCCCCCC(=O)OCC)=C1OC
MCULE-4240190020 0.66 CCOC1=C2C(CC(C(OC)=O)CO2)=CC=C1
MCULE-6945831774 0.66 C1(C)(C)OC2=C(C=CC(Br)=C2)C(=O)C1
MCULE-9381697452 0.66 C1OC2=C(C(C)=CC=C2)C(=O)C1
MCULE-5944462948 0.66 C1(C(CCC)=O)C=CC(=CC=1OC)OC
MCULE-6908653010 0.66 C1(C=CC(=CC=1OC)OC)C(=O)CC(C)C
MCULE-5050298992 0.66 C1(C=CC(=CC=1OC)OC)C(C(CC)CC)=O
MCULE-9706081272 0.66 C1(C=CC(=CC=1OC)OC)C(C(C)CC)=O
MCULE-7269199891 0.66 C1(C=CC(=CC=1OC)OC)C(=O)C(C)(C)CC
MCULE-7172292374 0.66 C1(C=CC(=CC=1OC)OC)C(=O)CC(C)(C)C
MCULE-6062655870 0.66 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=C(OC)C=3)CC(=O)C2=C(O)C=1
MCULE-3755625353 0.66 C12(C(O)=O)CC1C(C1=CC=C(OC)C=C1O2)=O
MCULE-6286398411 0.66 C1(O)C=C2O[C@H](C3C=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-4014167599 0.66 C12=C(C)C=C(C=C1OC(CC2=O)(C)C)OCCN1CCOCC1
MCULE-3714829206 0.66 C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-4953570630 0.66 C1(OC)=C(C=CC(C(=O)CCCCCC(=O)OCC)=C1OC)OC
MCULE-5305043344 0.66 C1(OC)=C(C=CC(=C1OC)C(=O)CCCCC(=O)OCC)OC
MCULE-2410958083 0.66 COC(C1(CC1)COC1=C2C(C(CC2)=O)=CC=C1)=O
MCULE-9152627041 0.66 C1(OC)=C(OC)C=CC(C(=O)CCCCCCC(=O)OCC)=C1OC
MCULE-8422648269 0.66 C12=CC(OC)=CC=C1CC(CO2)CC1C=CC=C(C=1)OCC(N)=O
MCULE-8799221854 0.66 COC1=CC(OC(CC(C2=CC=CC=C2)C2=CC=CC=C2)=O)=C(C(C)=O)C=C1
MCULE-7586369120 0.66 C12=C(CCC(C3=CC=CC=C3)O1)C=C(C=O)C(O)=C2C
MCULE-4202900635 0.66 C(=O)(C1=CC=CC=C1OCCCCCCCCCCCCCCCCCC)C(C(C)=O)C(OCC)=O
MCULE-5591774685 0.66 C12=CC3C=CC=CC=3C=C1OC1(CCCCC1)CC2=O
MCULE-7579242372 0.66 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC=C(OC)C=1OCC(C)=C)=O
MCULE-1487555472 0.66 COC1C(OC)=C2C(CCC2=O)=CC=1
MCULE-8379170848 0.66 C12OCCCCOC1=CC=C(C(CCC)=O)C=2
MCULE-4826422666 0.66 C1(=O)C2=C(C(OC)=CC(OC)=C2)CC1
MCULE-3078573589 0.66 CC1=CC2=C(OCCCC2=O)C(C)=C1
MCULE-2235188442 0.66 CC1=CC2=C(OCCCC2=O)C=C1
MCULE-8601307410 0.66 C1OC2=C(C=C(OC)C=C2)C[C@@H]1C(O)=O
MCULE-3501909123 0.66 C1(COC2C(=CC(=CC=2)OC)C1)C(O)=O
MCULE-3241754023 0.66 C1(C(=O)CC)C=C(C(OC)=CC=1OC)OC
MCULE-6243783933 0.66 CCCC1=C2C(C(CCO2)=O)=CC=C1
MCULE-6077709486 0.66 C1(C(CC)=O)=C(OC)C=C(C(OC)=C1O)OC
MCULE-6861091708 0.66 C1OC2=C(C=CC(C)=C2)C(=O)C1
MCULE-9181884957 0.66 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC(=CC=1)C(OC)=O)=O
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-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-3842882003 0.66 OC1C=CC([C@H]2OC3C(C(=O)C2)=CC(C/C=C(\C)/C)=C(OC)C=3)=CC=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-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-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-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-8473479842 0.66 OC1C(C/C=C(\C)/C)=CC(=CC=1OC)C1OC2C(C(=O)C1)=C(C=C(C=2)O)O
MCULE-6777649457 0.66 C12C=C(C)C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MolPort-006-417-663 0.66 CC1=C2C(=O)CCOC2=CC=C1
MolPort-008-605-689 0.66 COC1=CC(OC)=C(C=C1)C(=O)CC(C)C
MolPort-008-515-563 0.66 CCCC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-039-338-752 0.66 COC1=C(O)C=C(O)C(=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C(CC=C(C)C)=C2O1
MolPort-001-742-736 0.66 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=CC=C1O
MolPort-002-663-785 0.66 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NC1CC1)C=C2O
MolPort-019-937-165 0.66 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=CC=C1
MolPort-002-559-652 0.66 CCCCCCCCCCCCCCCCCCOC1=C(C=CC=C1)C(=O)C(C(C)=O)C(=O)OCC
MolPort-028-738-224 0.66 COC1=CC2=C(CC(CC3=CC(OCC(N)=O)=CC=C3)CO2)C=C1
MolPort-042-604-109 0.66 COC(=O)C1(COC2=CC=CC3=C2CCC3=O)CC1
MolPort-003-803-581 0.66 CC1=C2OC(CCC2=CC(C=O)=C1O)C1=CC=CC=C1
MolPort-004-056-560 0.66 COC1=CC=C(C(C)=O)C(OC(=O)CC(C2=CC=CC=C2)C2=CC=CC=C2)=C1
MolPort-035-873-329 0.66 COC1=CC=CC(C2CC(=O)OC3=CC=C4C(=O)CC5(CCCCC5)OC4=C23)=C1OCC(C)=C
MolPort-000-154-680 0.66 COC(=O)CC(=O)C1=CC=CC(OC)=C1OC
MolPort-013-264-387 0.66 CC1=CC2=C(OCCCC2=O)C(C)=C1
MolPort-002-023-365 0.66 COC1=CC=C2OCC(CC2=C1)C(O)=O
MolPort-003-982-380 0.66 COC1=CC=C2CCC(=O)C2=C1OC
MolPort-028-617-871 0.66 COC1=CC=C2OC[C@H](CC2=C1)C(O)=O
MolPort-002-464-665 0.66 CC1=CC2=C(OCCCC2=O)C=C1
MolPort-002-819-126 0.66 O=C1CC2(CCCCC2)OC2=CC3=CC=CC=C3C=C12
MolPort-001-763-617 0.66 CC1=CC2=C(C=C1)C(=O)CCO2
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-002-818-089 0.66 CCC(=O)C1=C(O)C(OC)=C(OC)C=C1OC
MolPort-001-004-322 0.66 CCC(=O)C1=C(OC)C=C(OC)C(OC)=C1
MolPort-039-063-554 0.66 CCC(C)C(=O)C1=C(OC)C(C)=C(O)C(C)=C1O
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-000-760-008 0.66 CC(C)=CCC1=C(O)C=C(O)C2=C1OC(CC2=O)C1=CC=CC=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-002-510-365 0.66 CC(C)=CCC1=C(O)C=C(O)C2=C1O[C@@H](CC2=O)C1=CC=CC=C1
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-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-039-056-283 0.65 COC1=C(O)C=C(C=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-000-671-075 0.65 COC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(C)C=C2C
MolPort-035-699-910 0.65 COC1=C(O)C=C(C=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-046-158-536 0.65 COC1=C(O)C=C2CC[C@H](OC2=C1)C1=CC=C(O)C=C1
MolPort-039-339-013 0.65 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-013-264-379 0.65 CC(C)C1=CC=C2OCCCC(=O)C2=C1
MolPort-000-157-926 0.65 COC(=O)CC(=O)C1=CC(OC)=C(OC)C(OC)=C1
MolPort-000-654-204 0.65 COC1=CC(C=O)=C2OCCCC2=C1
MolPort-039-339-031 0.65 COC1=CC=CC(OC)=C1CCC(=O)C1=CC=C(O)C=C1
MolPort-039-057-296 0.65 CC(C)[C@@H](CO)NC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-039-056-133 0.65 COC1=CC(=CC(OC)=C1O)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-035-705-963 0.65 CC(C)=CCC1=C(O)C=C2O[C@@H](CC(=O)C2=C1)C1=CC=C(O)C=C1
MolPort-035-683-152 0.65 O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=C(O)C=C(O)C=C1
MolPort-035-700-517 0.65 COC1=CC(=CC(OC)=C1O)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-046-790-429 0.65 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-009-018-976 0.65 COC1=CC(=CC=C1O)[C@H]1OC2=CC(=CC=C2OC1CO)C1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
MolPort-046-790-428 0.65 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-002-534-542 0.65 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-042-665-880 0.65 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-044-724-658 0.65 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-013-264-365 0.65 O=C1CCCOC2=C1C=C1CCCC1=C2
MolPort-016-633-341 0.65 COC1=CC(=CC=C1O)C1OC2=C(OC1CO)C=C(C=C2)C1OC2=C(C(O)=CC(O)=C2)C(=O)C1O
MolPort-001-741-606 0.65 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-020-006-004 0.65 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-001-913-435 0.65 COC1=C(O)C=CC(=C1)C1OC2=CC(=CC=C2OC1CO)C1OC2=C(C(O)=CC(O)=C2)C(=O)C1O
MolPort-039-139-345 0.65 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-004-955-569 0.65 OC1=C(C=CC=C1)C1CC(=O)C2=CC=CC=C2O1
MolPort-028-737-071 0.65 COC1=CC=CC2=C1OCC(CC1=CC=C(C=C1)C(N)=O)C2
MolPort-002-800-160 0.65 O=C1CC(OC2=CC=CC=C12)(C1=CC=CC=C1)C1=CC=CC=C1
MolPort-035-868-927 0.65 COC1=CC2=C(CCC2=O)C(OC)=C1C
MolPort-002-819-129 0.65 CC1(C)OC2=C(C=CC=C2)C(=O)C1Br
MCULE-3671796038 0.65 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC(=C(O)C=1)OC)=O
MCULE-4557119134 0.65 C1C(O)=C2C(=O)CC3(CCNCC3)OC2=CC=1
MCULE-7027720429 0.65 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=C(O)C=1)OC)=O
MCULE-1651216901 0.65 C1(=O)CC(C2=CC=C(C=C2)OC)OC2C=C(C)C=C(C)C1=2
MCULE-7563908675 0.65 C1=C(C(=CC(=C1OC)C(=O)CCCC(=O)OCC)OC)OC
MCULE-1656549385 0.65 C(OC1=C(OC(C)=O)C2=CC=CC=C2C2OC(C)(C)CCC1=2)(=O)CC
MCULE-7357907675 0.65 C1(COC2C(=CC=CC=2)C1=O)C(=O)C(OC)=O
MCULE-6509035779 0.65 C1(C(O)=O)CC2=CC=C(C=C2OC1=O)OC
MCULE-4797354319 0.65 C1(OCCCCCCCCCCCCCCCC)=CC=C(C(=O)CC(=O)OC)C=C1OC
MCULE-1581594019 0.65 C1(OCCCCCCCCCCCCCCCC)=CC=CC=C1C(=O)CC(=O)OC
MCULE-5435602548 0.65 C1(C(CCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OCCC
MCULE-1675694697 0.65 CC(C1=CC2=C(OCCCC2=O)C=C1)C
MCULE-6856311194 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(OC)C=1
MCULE-2081938620 0.65 C1(C=O)C=C(OC)C=C2CCCOC=12
MCULE-4816184552 0.65 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCCC
MCULE-9449184609 0.65 C1(C(CCCCC)=O)=CC=C(C=C1O)OCCCCC
MCULE-3279598301 0.65 C1(OC)C(OC)=CC(=CC=1OC)C(=O)CC(OC)=O
MCULE-4652067575 0.65 C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1C/C=C(\C)/C
MCULE-6039011943 0.65 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(=O)N[C@H](CO)C(C)C
MCULE-1604093945 0.65 C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-5659982548 0.65 [C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=C(C/C=C(\C)/C)C=C2C(=O)C1
MCULE-4215133965 0.65 C1(O)C=CC(C(=O)CCC2C(OC)=CC=CC=2OC)=CC=1
MCULE-3711190397 0.65 C12C(=O)CC(C)(C)OC=1C=C(C=C2)OCC1C=CC(N(=O)=O)=CC=1
MCULE-5100213794 0.65 C1(O)C=CC(C(CCC2C(OC)=CC(O)=CC=2OC)=O)=CC=1
MCULE-2297605054 0.65 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=C(OC)C(=C(OC)C=1)O)=O
MCULE-7187345156 0.65 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC(OC)=C(C(OC)=C1)O)=O
MCULE-1908546351 0.65 C1(C=CC(=CC=1OC)OC)C(=O)C1CC1
MCULE-3727519669 0.65 C1(C=CC=CC=1OC(C)C)C(CCC1C=CC=CC=1)=O
MCULE-9566565950 0.65 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-6463439345 0.65 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-7201821938 0.65 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 0.65 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
MCULE-4152291525 0.65 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-8379030042 0.65 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-9092075985 0.65 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-6390383057 0.65 COC1C=C(C2C(CO)OC3C=C(C4C(O)C(=O)C5C(=CC(=CC=5O)O)O4)C=CC=3O2)C=CC=1O
MCULE-9222758717 0.65 C1(OC)=C(C=CC(=C1OC)C(=O)CCCC(=O)OCC)OC
MCULE-6854338934 0.65 O=C1C2=C(C=C3C(=C2)CCC3)OCCC1
MCULE-6814312961 0.65 C1(C2C=CC=CC=2)(C2C=CC=CC=2)CC(=O)C2=C(C=CC=C2)O1
MCULE-5879964884 0.65 O1CC(CC2=CC=C(C=C2)C(N)=O)CC2=CC=CC(OC)=C12
MCULE-2660644517 0.65 C1(C2C=CC=CC=2O)CC(=O)C2C(=CC=CC=2)O1
MCULE-5194625427 0.65 C1(=O)C2=CC=CC=C2OC(C)(C)C1Br
MCULE-3262674799 0.65 O=C1C2C=C(C(=C(OC)C=2CC1)C)OC
MCULE-9649438176 0.65 CC1=C2C(C(CCO2)=O)=C(C)C=C1
MCULE-2650174810 0.65 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-5150775484 0.65 CCOC1=CC2=C(OCC(C(O)=O)C2)C=C1
MCULE-6612299602 0.65 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-3585893701 0.65 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCC#N)=O
MCULE-9688299119 0.65 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC(=C(Cl)C=1)Cl
MCULE-8275106243 0.65 C12OC(CC(=O)C=1C=CC(OCC1=CC(=CC(C(F)(F)F)=C1)C(F)(F)F)=C2C)(C)C
MCULE-7113486032 0.65 O=C1C2=C(C=CC=C2)OCCC1
MCULE-6416168758 0.65 C1(=CC=C(C=C1OC)OC)C(CCC(O)=O)=O
MCULE-9335884970 0.65 C1=CC(CCC(=O)OC)=C(OC)C(OC)=C1OC
MCULE-9936156290 0.65 C1=C(OC)C=CC(=C1OC)C(CC(C)(C(=O)O)C)=O
MCULE-8744806299 0.65 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=C(OC)C2=C(OCCO2)C=1)=O
MCULE-5934275257 0.65 C1(O)C=C2C(=O)CC3(CCNCC3)OC2=CC=1
MCULE-1164343900 0.65 [H]Cl.C12(CCNCC1)OC1=CC=CC(O)=C1C(=O)C2
MCULE-6056489539 0.65 C12C(CCC(C)(C)O1)=CC1=C(OC(CC1)(C)C)C=2C
MCULE-5711074607 0.65 C12(C(O)=O)CC1C1C(=CC(=CC=1)OC)OC2=O
MCULE-2186114470 0.65 C1(C(CC)=O)=CC=C(C=C1O)OCCCC
MCULE-5099627675 0.65 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(NCCC1C=CC(=C(OC)C=1)OC)=O
MCULE-6924983703 0.65 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-3965785693 0.65 C1(C2=CC=C(OCC3=CC=CC=C3)C(OCC3=CC=CC=C3)=C2)OC2=C(C=CC=C2)C(=O)C1O
MCULE-1761059072 0.65 CN(S(CCCOC1=CC2=C(C(CC(O2)(C)C)=O)C=C1)(=O)=O)C
MCULE-2777928047 0.65 C12C(O)=CC(=CC=1OC(CC2=O)(C)C)OCC(NCCCC)=O
MCULE-9485581712 0.65 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 0.65 C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1
MCULE-2872239229 0.65 C12=C(O)C=C(C=C1OC1(CC2=O)CCN(CC1)C(C)=O)O
MCULE-8102344085 0.65 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC2=C(OCO2)C=1)=O
MCULE-5345753150 0.65 C12=CC(OC)=CC=C1OC(CC2=O)C1=CC=C(C=C1)F
MCULE-1856169560 0.65 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1=CC(OC)=C(C(OC)=C1)OC)=O
MCULE-1006196018 0.65 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=C(OC)C(=C(OC)C=1)OC)=O
MCULE-6183149081 0.65 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)OCCCCCCCC
MCULE-5976933280 0.65 O=C(CC(=O)C1C(OC)=CC=C(OC)C=1)OC
MCULE-7471184494 0.65 C12=C(C=CC3=CC(Br)=CC=C13)OCC(C)C2=O
MCULE-9279110671 0.65 C1(C(CCCCCCCCC)=O)=CC=C(C=C1O)OCCCCCCCC
MCULE-4242616899 0.65 C1(C(CCCCCCCCCCC)=O)C=CC(=CC=1O)OCCCCCCCCCC
MCULE-2606502445 0.65 C1C(O)=C(C(=O)CCCCC)C=CC=1OCCCCCCCCCC
MCULE-8076299220 0.65 C1(=CC(C)=CC=C1O)C(=O)CC(=O)C1=CC(OC)=CC=C1OC
MCULE-2838900881 0.65 C1(C(CCCCCCCC)=O)=CC=C(C=C1O)OCCCCCC
MCULE-4208394266 0.65 C1(C(CCCCCC)=O)C=CC(=CC=1O)OCCCCCC
MCULE-2808039967 0.65 O1C2=CC(OC)=C(OC)C=C2C2(C(C3C(=C4CC(C(C)C)OC4=CC=3)OC2(C1)[H])=O)[H]
MCULE-4060250781 0.65 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-8744659707 0.65 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(O)=C(O)C=1
MCULE-3387577878 0.65 C1(O)=CC(C)=CC=C1C(=O)CC(=O)C1C=CC=CC=1OC(C)C
MCULE-6108739269 0.65 CC(C1=C2C(C(CCO2)=O)=CC=C1)C
MCULE-3248081431 0.65 C(=O)(CC(OC)=O)C1C=CC=CC=1OC(C)C
MCULE-7127796228 0.65 C1(C=CC(=C(O)C=1)OCCCC(O)=O)C(CC)=O
MCULE-2672910660 0.65 C1(=CC(C)=CC=C1O)C(=O)CC(=O)C1C=CC=CC=1OC(C)C
MCULE-2170720822 0.65 COC1=C(OC)C(OC)=C(CCC(O)=O)C=C1
MCULE-1774195498 0.65 O1C(C)(C)CCC2=CC(C(C)=O)=CC=C12
MCULE-2034677841 0.65 C12(COC3=C(C=CC=C3)C1=O)CC2C1C=CC=CC=1F
MCULE-4787929533 0.65 C1C=C2OCCC(=O)C2=C2CCCCC2=1
MCULE-4387068084 0.65 C(CCC1C(C)=CC(OC)=C(OCC2C=CC=CC=2)C=1)(C1C(O)=CC(OC)=C(OC)C=1)=O
MCULE-6374209365 0.65 C12CCCOC=1C=CC(CCC(C)=O)=C2
MCULE-7064992733 0.65 C(O)(=O)C(CC)CC1C=CC(=CC=1OC)OC
MolPort-039-337-155 0.65 COC1=C(CC=C(C)C)C=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C=C(O)C=C2O
MolPort-002-472-692 0.65 CCOC1=CC=C2OCC(CC2=C1)C(O)=O
MolPort-005-945-465 0.65 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-008-645-060 0.65 CC1=CC=C(C)C2=C1OCCC2=O
MolPort-000-693-540 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC(Cl)=C(Cl)C=C1)C=C2O
MolPort-000-150-651 0.65 O=C1CCCOC2=CC=CC=C12
MolPort-006-328-861 0.65 COC(=O)CCC1=CC=C(OC)C(OC)=C1OC
MolPort-035-874-087 0.65 COC1=CC(=CC2=C1OCCO2)C1CC(=O)OC2=CC=C3C(=O)CC4(CCCCC4)OC3=C12
MolPort-005-919-521 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)NCC#N)C=C2O
MolPort-002-914-767 0.65 CC1=C(OCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C=CC2=C1OC(C)(C)CC2=O
MolPort-002-025-003 0.65 COC1=CC(OC)=C(C=C1)C(=O)CCC(O)=O
MolPort-002-846-540 0.65 CC1=C2OC(C)(C)CCC2=CC2=C1OC(C)(C)CC2
MolPort-000-855-846 0.65 COC1=CC=C(CCNC(=O)COC2=CC3=C(C(=O)CC(C)(C)O3)C(O)=C2)C=C1OC
MolPort-035-772-705 0.65 OC1=C(Cl)C=C2C(=O)CCOC2=C1
MolPort-006-668-563 0.65 CC(C)=CCC1=C2O[C@@H](CC(=O)C2=CC=C1O)C1=CC=C(O)C=C1
MolPort-000-847-209 0.65 CCCCNC(=O)COC1=CC2=C(C(=O)CC(C)(C)O2)C(O)=C1
MolPort-020-163-530 0.65 CN(C)S(=O)(=O)CCCOC1=CC=C2C(=O)CC(C)(C)OC2=C1
MolPort-001-740-177 0.65 CC(C)=CCC1=CC(=CC(CC=C(C)C)=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-006-668-332 0.65 CC(C)=CCC1=C(O)C=CC(=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-039-056-579 0.65 COC1=CC(=CC(OC)=C1OC)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-035-873-369 0.65 O=C1CC(C2=CC3=C(OCO3)C=C2)C2=C3OC4(CCCCC4)CC(=O)C3=CC=C2O1
MolPort-018-503-787 0.65 COC1=CC(C(=O)CC(=O)C2=C(O)C=CC(C)=C2)=C(OC)C=C1
MolPort-000-424-521 0.65 COC1=CC2=C(OC(CC2=O)C2=CC=C(F)C=C2)C=C1
MolPort-035-700-203 0.65 COC1=CC(=CC(OC)=C1OC)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-008-667-280 0.65 COC(=O)CC(=O)C1=C(OC)C=CC(OC)=C1
MolPort-002-893-977 0.65 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-008-645-057 0.65 CCC1=CC=CC2=C1OCCC2=O
MolPort-004-343-375 0.65 COC1=CC=C(CCC(O)=O)C(OC)=C1OC
MolPort-035-705-949 0.65 OC1=CC2=C(C(=O)C(O)(CC3=CC(O)=C(O)C(O)=C3)O2)C(O)=C1
MolPort-002-818-057 0.65 CC(=O)C1=CC2=C(OC(C)(C)CC2)C=C1
MolPort-046-766-090 0.65 [Na+].COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(OS([O-])(=O)=O)C=C2O1
MolPort-029-882-356 0.65 CC(C)OC1=C(C=CC=C1)C(=O)CC(=O)C1=C(O)C=C(C)C=C1
MolPort-002-512-152 0.65 CCC(=O)C1=CC(O)=C(OCCCC(O)=O)C=C1
MolPort-008-646-900 0.65 CC(C)C1=CC=CC2=C1OCCC2=O
MolPort-018-503-802 0.65 CC(C)OC1=C(C=CC=C1)C(=O)CC(=O)C1=C(O)C=CC(C)=C1
MolPort-002-857-770 0.65 FC1=C(C=CC=C1)C1CC11COC2=CC=CC=C2C1=O
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-028-735-185 0.65 CNC(=O)C1=CC=C(CC2COC3=C(C2)C=CC(OC)=C3)C=C1
MolPort-002-071-461 0.64 COC1=CC2=C(C=C1)C(=O)CC1(CCN(CC3=CC=CC=C3)CC1)O2
MolPort-044-807-256 0.64 COC(COC1=CC=C2C(=O)CC3(CCCCC3)OC2=C1)C1CCOC1
MolPort-021-893-451 0.64 FC(F)(F)OC1=CC2=C(OCCC2=O)C=C1
MolPort-013-264-354 0.64 CC1=CC2=C(C=C1C)C(=O)CCCO2
MolPort-034-339-626 0.64 CCOC(=O)C1COC2=CC=CC=C2C1=O
MolPort-039-057-489 0.64 COC1=C(O)C=CC(=C1)C1CC(=O)OC2=CC=C(C(=O)C3=CC=CC=C3)C(O)=C12
MolPort-035-700-252 0.64 COC1=C(O)C=CC(=C1)C1CC(=O)OC2=CC=C(C(C)=O)C(O)=C12
MolPort-035-772-664 0.64 Cl.OC1=CC=C2OC3(CCNCC3)CC(=O)C2=C1
MolPort-039-337-150 0.64 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-039-338-650 0.64 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-039-338-549 0.64 CC(C)=CCCC1(C)CCC2=C3OC(CC(=O)C3=C(O)C=C2O1)C1=C(O)C=C(O)C=C1
MolPort-013-264-339 0.64 O=C1CCCOC2=C1C=CC1=CC=CC=C21
MolPort-035-874-197 0.64 COC1=CC(OC)=C(C=C1OC)C1CC(=O)OC2=CC(OC)=C(OC)C(OC)=C12
MolPort-035-873-945 0.64 COC1=CC(OC)=C(C=C1)C1CC(=O)OC2=CC(OC)=C(OC)C(OC)=C12
MolPort-035-873-539 0.64 COC1=C(OC)C(OC)=C(C=C1)C1CC(=O)OC2=CC(OC)=C(OC)C(OC)=C12
MolPort-007-926-789 0.64 CCOC(=O)COC1=CC2=C(OC(C)(C)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-000-144-689 0.64 CC1(C)CCC2=C(O1)C=CC(C=O)=C2
MolPort-039-338-719 0.64 CC(C)=CCC1=C(O)C(CC=C(C)C)=C2O[C@@H](CC(=O)C2=C1O)C1=CC=C(O)C=C1O
MolPort-006-668-453 0.64 CC(C)(O)C1CC2=C(O1)C=CC(C(=O)CCC1=CC=CC=C1)=C2O
MolPort-001-739-251 0.64 CCCC(=O)C1=C(OC)C=C(O)C(CC)=C1O
MolPort-001-742-561 0.64 CC(C)=CCOC1=CC2=C(C(O)=C1)C(=O)[C@H](O)[C@H](O2)C1=CC=C(O)C=C1
MolPort-035-701-350 0.64 COC1=CC(OC)=C(C=C1OC)C(CC(O)=O)C1=C(O)C(=CC=C1O)C(C)=O
MolPort-000-004-267 0.64 COC(=O)CC(=O)C1=C(O)C=C(OC)C=C1
MolPort-000-843-169 0.64 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)N1CCCC1)C=C2O
MolPort-046-793-183 0.64 COC1=C(O)C=CC(=C1)C1OC2=C(C=C(C=C2O)C2OC3=CC(O)=CC(O)=C3C(=O)C2O)C1CO
MolPort-028-735-837 0.64 COC1=CC=CC2=C1OCC(CC1=CC=C(OCC(N)=O)C=C1)C2
MolPort-006-069-276 0.64 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-046-790-479 0.64 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-042-652-849 0.64 CC1(C)CC(=O)C2=C(O1)C=C(C=C2)C#N
MolPort-039-360-932 0.64 CN1C=C(CCOC2=CC=C3C(=O)CC(C)(C)OC3=C2)C=N1
MolPort-030-005-232 0.64 OC1=CC2=C(C=C1F)C(=O)CCO2
MolPort-001-740-746 0.64 COC1=CC2=C(C(O)=C1)C(=O)[C@H](OC(C)=O)[C@H](O2)C1=CC(O)=C(O)C=C1
MolPort-046-790-344 0.64 COC1=C(CCC(=O)C2=CC=C(O)C=C2)C(O)=CC(O)=C1
MolPort-039-338-490 0.64 COC1=C(CCC(=O)C2=CC=C(O)C=C2)C=CC(O)=C1
MolPort-005-748-963 0.64 COC1=CC(CCC(=O)OC2=CC=C(C=C2)C(=O)C2=CC=CC=C2)=CC(OC)=C1OC
MolPort-027-879-580 0.64 COC1=CC2=C(CC(CC3=CC=C(CC(N)=O)C=C3)CO2)C=C1
MolPort-008-771-415 0.64 COC(=O)CCC(=O)C1=C(OC)C=C(OC)C=C1
MolPort-002-805-025 0.64 COC1=C(OC)C2=C(C=C1)C(=O)CC2
MolPort-028-586-688 0.64 CNC(=O)C1=CC=C(OC)C(CC2COC3=C(C2)C=CC=C3OC)=C1
MolPort-002-818-069 0.64 CCC(CO)C(=O)C1=C(O)C=C(OCC2=CC=CC=C2)C=C1
MCULE-5745942938 0.64 C1=C(OC)C=CC(C(=O)CCCCC(=O)O)=C1OC
MCULE-7083569963 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)C1C=CC=C(C=1)N(=O)=O
MCULE-9536770631 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(NCCCOC)=O
MCULE-6963051080 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)NCC(C)(C)CN(C)C
MCULE-3123185458 0.64 C1(C(=O)C2C=CC(=CC=2OCC2=CC=CC=C2)OC)C(O1)C1=CC=C2C(OCCCO2)=C1
MCULE-2617430777 0.64 C1(=CC=C(C(OC)=C1)OCCC(C)C)C(CC)=O
MCULE-4053954850 0.64 C1(=CC=C(C(OC)=C1)OCCCC)C(CC)=O
MCULE-3994559440 0.64 C1C(O)=C(C(=O)CCCCCCCCC)C=CC=1OCCC
MCULE-6829744393 0.64 C1(C=C(C)C=CC=1OCCCCC)C(CC)=O
MCULE-7823431861 0.64 C1C=C2C(=O)CC(OC2=CC=1)C1C=CC(C(=O)OC)=CC=1
MCULE-8693767927 0.64 C12=CC(OC)=CC=C1CC(CO2)CC1=CC=C(C=C1)C(NC)=O
MCULE-1664617977 0.64 COC1=CC=C2C(OC3(CC2=O)CCN(CC2=CC=CC=C2)CC3)=C1
MCULE-2059687691 0.64 O=C1C2C=C(C=CC=2OCC1)OC(F)(F)F
MCULE-9998095829 0.64 CC1=C(C)C=C2C(OCCCC2=O)=C1
MCULE-4806891809 0.64 COC(C1COCC1)COC1=CC2=C(C(CC3(O2)CCCCC3)=O)C=C1
MCULE-4642252308 0.64 COC(C1CC2=C(C=CC(=C2)OC)OC1)=O
MCULE-4795106614 0.64 C12=C(C=CC(C(C)=O)=C1O)OC(CC2C1C=CC(=C(OC)C=1)O)=O
MCULE-5545922178 0.64 C12=C(C=CC(C(C3=CC=CC=C3)=O)=C1O)OC(CC2C1C=CC(=C(OC)C=1)O)=O
MCULE-7456571477 0.64 C12C(=CC=C3C=CC=CC=13)OCCCC2=O
MCULE-3547616904 0.64 C12OC(C)(CC/C=C(/C)\C)CCC1=C1OC(C3C=CC(O)=CC=3O)CC(=O)C1=C(O)C=2
MCULE-2488560176 0.64 C12C(=CC(=C(OC)C=1OC)OC)OC(CC2C1C=CC(=C(OC)C=1OC)OC)=O
MCULE-3559522784 0.64 C12=CC(C)=CC=C1OC(CC2=O)C1C=CC(=CC=1)Br
MCULE-1986013430 0.64 C12C(=CC(=C(OC)C=1OC)OC)OC(CC2C1C=CC(=CC=1OC)OC)=O
MCULE-9739077956 0.64 C12C(=CC(=C(OC)C=1OC)OC)OC(CC2C1C=C(OC)C(=CC=1OC)OC)=O
MCULE-2994311082 0.64 O=C1C2=CC=C3C(=C2OCCC1)C=CC=C3
MCULE-4717924797 0.64 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-5212006601 0.64 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-8390027311 0.64 C12=CC(=CC=C1OC(CC2=O)(C)C)OCC(OCC)=O
MCULE-4617683717 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=1C/C=C(\C)/C
MCULE-6930739422 0.64 C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1=CC=C(C=C1)O)OC/C=C(\C)/C
MCULE-8847813226 0.64 C1(=C(O)C=CC(C(C)=O)=C1O)C(CC(O)=O)C1C=C(OC)C(=CC=1OC)OC
MCULE-4911952817 0.64 C12OC(C(O)(C)C)CC=1C(O)=C(C(=O)CCC1C=CC=CC=1)C=C2
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-4964942191 0.64 C1C(=C(C(=C(C=1O)CC)O)C(=O)CCC)OC
MCULE-8770028986 0.64 C1(OC)C(OC)=CC(=CC=1OC)C(CCC1=CC=C(C(O)=C1)OC)=O
MCULE-7112103458 0.64 C1(=CC(=CC=C1OC)OC)C(CCC1C=CC=CC=1)=O
MCULE-9385881266 0.64 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-8990591543 0.64 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(=O)N1CCCC1
MCULE-4640734168 0.64 CN1N=CC(CCOC2=CC3=C(C(CC(O3)(C)C)=O)C=C2)=C1
MCULE-3778540596 0.64 C12(C(OC)=O)CC1C(C1=CC=C(OC)C=C1O2)=O
MCULE-1891817974 0.64 C1(C)(C)OC2=CC(C#N)=CC=C2C(=O)C1
MCULE-3688085298 0.64 CC1C=C2C(=O)CC3(COC3)OC2=CC=1
MCULE-4246480779 0.64 O1CC(CC2=CC=C(C=C2)OCC(N)=O)CC2=CC=CC(OC)=C12
MCULE-5775761807 0.64 C1(O)C=CC(C(=O)CCC2C=CC(O)=CC=2OC)=CC=1