SANC00555 12,13-Dihydroxychina-8,11,13-trien-7-one



Download SMILES        
Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-8418521945 0.95 CC1([C@@H]2CC(C3=C([C@@]2(C)CCC1)C(O)=C(O)C(C(C)C)=C3)=O)C
MolPort-003-804-191 0.95 CC(C)C1=CC2=C(C(O)=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2=O
MolPort-019-936-838 0.95 CC(C)C1=C(O)C=C2C(=C1)C(=O)C[C@H]1C(C)(C)CCC[C@]21C
MCULE-7647264271 0.89 C1C[C@@]2(C3C=C(O)C(O)=CC=3C(=O)CC2C(C)(C)C1)C
MolPort-001-741-318 0.89 CC1(C)CCC[C@@]2(C)C1CC(=O)C1=C2C=C(O)C(O)=C1
MolPort-021-780-622 0.87 CC1=C(O)C=CC2=C1CCCC2=O
MCULE-2477573595 0.87 C12CCCC(=O)C1=CC=C(O)C=2C
MolPort-039-338-887 0.86 CC(C)C1=C(O)C(O)=C2C(C=CC3=C2C(=O)CCC3(C)C)=C1
MCULE-6098753926 0.86 C1=CC2C3CCCCC3CC(=O)C=2C=C1O
MolPort-046-766-201 0.85 C[C@]12CC[C@@H]3[C@@H](CC(=O)C4=C3C=CC(O)=C4)[C@H]1CCC2=O
MolPort-004-964-119 0.84 C[C@]12CC[C@H]3[C@@H](CC(=O)C4=CC(O)=CC=C34)[C@@H]1CC[C@@H]2O
MCULE-6496781996 0.82 C(O)(=O)CC1(CCC)CCC2=C(C1=O)C=CC(O)=C2
MolPort-039-338-583 0.82 CC(C)C1=CC(C=O)=C(C=C1O)[C@@]1(C)CCCC(C)(C)C1C=O
MolPort-039-338-879 0.81 CC(C)C1=CC2=C(C=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1[C@@H](O)C2=O
MCULE-6800775588 0.81 C12C=CC(O)=CC=1CCCCC2=O
MCULE-8786060775 0.81 OC1=CC2=C(CCCCC2=O)C=C1
MolPort-039-239-478 0.81 OC1=CC2=C(CCCCC2=O)C=C1
MCULE-8190718465 0.80 C(O)(=O)CC1(C)CCC2=C(C1=O)C=CC(O)=C2
MCULE-5301674401 0.80 C(O)(=O)CC1(CC)CCC2=C(C1=O)C=CC(O)=C2
MCULE-4117710386 0.79 C12C=C(C=C(O)C=1CCCCC2=O)O
MCULE-4459132778 0.79 OC1=CC2=C(C(CCC2)=O)C=C1
MCULE-8090583332 0.79 C1C[C@]2(C)C3C=CC(O)=C(C(C)C)C=3CC[C@@]2([H])[C@@](C)(C(O)=O)C1
MCULE-6491313993 0.79 OC1C=CC(C(=O)C)=C2CCCC=12
MolPort-009-198-420 0.79 OC1=CC=C2CCCC(=O)C2=C1
MolPort-001-828-311 0.79 OC1=CC2=C(C=C1)C(=O)CCC2
MolPort-046-419-390 0.79 CC(=O)C1=C2CCCC2=C(O)C=C1
MolPort-039-141-829 0.79 CC(C)C1=C2CC[C@H]3[C@](C)(CCC[C@]3(C)C2=CC=C1O)C(O)=O
MCULE-2210298770 0.78 O=C1C2C=CC(=C(O)C=2CCC1)C
MCULE-3788622108 0.78 C12CCCC(=O)C1=CC=C(OC)C=2C
MolPort-035-691-155 0.78 CC1=CC=C2C(=O)CCCC2=C1O
MolPort-003-920-548 0.77 COC1=C(C)C2=C(C=C1)C(=O)CCC2
MCULE-8824126804 0.77 C12C=CC=C(O)C=1CCCC2=O
MolPort-044-830-355 0.77 C[C@]12CC[C@H]3[C@@H](CC(=O)C4=C3C=CC(O)=C4)[C@@H]1CC[C@@]2(O)C#C
MolPort-001-763-744 0.77 OC1=C2CCCC(=O)C2=CC=C1
MolPort-005-945-880 0.76 COC1=C(O)C=C2C(=C1)C(=O)CC1C(C)(C)C(O)CCC21C
MolPort-035-813-500 0.76 COC1=CC2=C(CCCC2=O)C(C)=C1
MCULE-5385319007 0.76 C1CC2(C)C3=C(C(=O)CC2C(C)(C)C1O)C=C(OC)C(O)=C3
MCULE-4136813518 0.76 C12=CC(OC)=CC(C)=C1CCCC2=O
MCULE-5461446990 0.76 C1(C(C)=O)=CC2CCCCC=2C(C)=C1O
MCULE-4768578853 0.76 C12C(CCCC1=CC(OC)=CC=2C)=O
MCULE-4546853723 0.76 C12CC[C@]3(C(CCC3=O)[C@]1([H])CCC1C(=CC=C(O)C2=1)C)C
MCULE-8074963671 0.76 C12C(CCCC1=C(C=C(OC)C=2C)C)=O
MolPort-035-813-501 0.76 COC1=CC2=C(C(=O)CCC2)C(C)=C1
MolPort-002-509-301 0.76 CC1=CC=C(O)C2=C1CC[C@H]1C3CCC(=O)[C@@]3(C)CCC21
MolPort-028-912-998 0.76 COC1=C(C)C2=C(CCCC2=O)C(C)=C1
MolPort-039-137-049 0.75 COC1=C(C)C2=C(CCCC2=O)C=C1
MCULE-9997798336 0.75 O=C1C2C(=C(C=CC=2CCC1)OC)C
MCULE-2564964861 0.75 C1(C(C)(C)C)C(O)=C(C(C)(C)C)C=C(C(C2CCCCCC2)=O)C=1
MCULE-5768810188 0.75 C1(C(=C2C(=CC=1O)CC(O)CC2=O)C)C(=O)C
MCULE-9723785414 0.75 CC(C1=C(O)C=C2C(CCCC2)=C1)=O
MolPort-001-739-528 0.75 CC(=O)C1=C(O)C=C2CC(O)CC(=O)C2=C1C
MolPort-016-636-089 0.75 CC(=O)C1=CC2=C(CCCC2)C=C1O
MolPort-019-913-535 0.74 COC1=C(C)C=C2C(=O)CCCC2=C1
MolPort-046-690-033 0.74 [2H]C1=C([2H])C2=C(CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@H]23)C(O)=C1O
MolPort-003-941-687 0.74 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CCC2=O
MCULE-9795126474 0.74 C12C(CCCC1=CC(=C(C)C=2)OC)=O
MCULE-5384164618 0.74 O=C1CCCC(C2C(O)=CC=C(O)C=21)=O
MCULE-7780163081 0.74 C1C(O)=C2C(=O)CCCC2=CC=1
MCULE-6553755259 0.74 C(OCC)(=O)CC1(CCC)CCC2=C(C1=O)C=CC(O)=C2
MCULE-8216200508 0.74 C12C(=O)CCC(=O)C1=C(O)C=CC=2O
MolPort-046-690-032 0.74 [2H]C1=C2CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@@H]3C2=C([2H])C(O)=C1O
MolPort-004-964-485 0.74 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@@H]1CCC2=O
MolPort-029-419-168 0.73 COC1=CC2=C(C=C1)C(=O)CC(C)C2
MolPort-039-101-197 0.73 CC(C)C1=CC2=C(C=C1O)[C@]1(CCCC(C)(C)C1CC2)C=O
MolPort-002-800-378 0.73 CC1(CCCC2(C)C1CCC1=C2C=C(O)C=C1)C([O-])=O
MolPort-039-338-378 0.73 C[C@]1(CCC[C@@]2(C)[C@H]1CCC1=C2C=CC(O)=C1)C(O)=O
MolPort-001-742-608 0.73 C[C@@]1(CCC[C@@]2(C)[C@H]1CCC1=C2C=C(O)C=C1)C(O)=O
MolPort-003-936-051 0.73 CC(C)C1=C(O)C=CC2=C1CC[C@H]1C(C)(C)CCC[C@]21C
MolPort-003-702-314 0.73 CCCCCCCCCCCCCCCCCC(=O)C1=CC(O)=C(O)C=C1
MolPort-002-506-945 0.73 CCCCCCCCCCCCCCCCC(=O)C1=CC(O)=C(O)C=C1
MCULE-4964796787 0.73 COC1=CC=C2C(CCC(CC(O)=O)C2=O)=C1
MCULE-2730971863 0.73 C1C[C@]2(C=O)C3C=C(O)C(C(C)C)=CC=3CCC2C(C)(C)C1
MCULE-7977772608 0.73 C1C[C@]2(C)C3C=CC(O)=CC=3CC[C@@]2([H])[C@@](C(=O)O)(C)C1
MCULE-9446646293 0.73 [C@]1(C)(C(O)=O)[C@@]2([H])[C@@](C)(C3=C(CC2)C=CC(O)=C3)CCC1
MCULE-6501959537 0.73 C1(C)=C2CCCCC2=CC(C=O)=C1O
MCULE-8369774775 0.73 C12(C)CCCC(C)(C(O)=O)C1([H])CCC1C=CC(O)=CC2=1
MCULE-3230130162 0.73 [C@]12(C)CCCC(C)(C)[C@]1([H])CCC1C(C(C)C)=C(O)C=CC2=1
MCULE-6983208431 0.73 C1(=CC=C(C(O)=C1)O)C(CCCCCCC)=O
MCULE-6237440368 0.73 C1(=CC=C(C(O)=C1)O)C(CCCCC)=O
MCULE-2036779208 0.73 C1(=CC=C(C(O)=C1)O)C(CCCCCCCCCCCCCCCC)=O
MCULE-9491292679 0.73 C1(C=CC(=C(O)C=1)O)C(CCCCCCCCCCCCCCCCC)=O
MCULE-2268342844 0.73 C1(=CC=C(C(O)=C1)O)C(CCCCCCCCC)=O
MCULE-1483614196 0.73 C1(C=CC(=C(O)C=1)O)C(CCCCCCCCCCC)=O
MCULE-5413966075 0.73 C12C(CCCC1=CC(=C(OC)C=2)C(C)(C)C)=O
MCULE-5478586058 0.73 C12C(CCCC1=CC(=C(OC)C=2)C(C)C)=O
MCULE-2144279577 0.73 C12C=CC(OC)=CC=1CCC(CCC(=O)O)(C)C2=O
MCULE-3699865224 0.73 C1C=C2C(C(CCC2=CC=1OC)C(C(C)(C)C(=O)O)CC)=O
MCULE-3970249846 0.73 C12C(=O)CCC(=O)C1=C(C1C=CC=CC=1C=2O)O
MCULE-8816680307 0.73 C(OCC)(=O)CC1(C)CCC2=C(C1=O)C=CC(O)=C2
MCULE-5790475131 0.73 C(OCC)(=O)CC1(CC)CCC2=C(C1=O)C=CC(O)=C2
MCULE-1666587123 0.73 C(OCC)(=O)CC1CCC2=C(C1=O)C=CC(O)=C2
MolPort-028-912-999 0.73 COC1=C(C=C2CCCC(=O)C2=C1)C(C)C
MolPort-028-913-000 0.73 COC1=C(C=C2CCCC(=O)C2=C1)C(C)(C)C
MolPort-002-506-948 0.73 OC1=C2C(=O)CCC(=O)C2=C(O)C2=CC=CC=C12
MolPort-022-393-467 0.73 COC1=CC2=C(C=C1)C(=O)C(CC(O)=O)CC2
MolPort-002-499-602 0.73 COC1=CC=C2C(CCCCC2=O)=C1
MolPort-003-807-995 0.72 COC1=C(OC)C=C2C(CCCCC2=O)=C1
MolPort-046-689-731 0.72 [2H]C1([2H])C[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]2(C)C1=O
MolPort-003-934-773 0.72 [2H]C1=CC2=C(CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@H]23)C([2H])=C1O
MolPort-006-394-004 0.72 C[C@]12CCC3[C@@H](CCC4=CC(O)=CC=C34)C1CCC2=O
MolPort-044-561-948 0.72 [2H]C1=C(O)C([2H])=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3C2=C1
MolPort-001-832-299 0.72 CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2=O
MolPort-002-506-974 0.72 C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2=O
MolPort-001-742-529 0.72 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
MolPort-000-723-173 0.72 OC1=CC2=C(C=C1)C(CCC2=O)C1=CC=CC=C1
MolPort-022-372-807 0.72 OC1=C(C=O)C=C2CCCCC2=C1
MCULE-2550305614 0.72 C1(C(C)=CC(=C(C)C=1)OC)C(C1CCCCC1)=O
MCULE-2469526342 0.72 C12C=CC(=CC=1CCCCC2=O)OC
MCULE-5476163838 0.72 C1(=O)C2=C(C(C)=C(O)C=C2)CC1
MCULE-6615716189 0.72 C12CCCCC(=O)C1=CC(=C(OC)C=2)OC
MCULE-3828376079 0.72 C12=CC=C(C=C1C(CCC2C1C=CC=CC=1)=O)O
MCULE-9935676959 0.72 C12=C(C)C=CC(OC)=C1CCCC2=O
MCULE-8329779101 0.72 C1(C(O)=CC=C(C(C)(C)C)C=1)C(CCCCCCCCCCC)=O
MCULE-7594966976 0.72 C12=CC(OC)=CC=C1CCCCC2=O
MolPort-002-694-209 0.72 COC1=CC=C(C)C2=C1CCCC2=O
MolPort-035-705-846 0.71 CC(C)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@@](C)(CO)[C@@H]1CC2=O
MolPort-019-880-414 0.71 COC1=C(C)C=C2CCCC(=O)C2=C1
MolPort-046-628-957 0.71 CCCCCCCCC(=O)C1=CC(O)=C(O)C(O)=C1
MolPort-014-726-636 0.71 O=C1CCCC2=CC=C(C=C12)C1CCCCC1
MolPort-028-912-997 0.71 COC1=CC(C)=C(C)C2=C1CCCC2=O
MolPort-001-740-852 0.71 CC(C)C1=C(O)C=C2C(CC[C@H]3C(C)(C)CCC[C@]23C)=C1
MCULE-2234351379 0.71 C1C[C@]2(C)C3C=CC(C(C)C)=CC=3C(=O)C[C@@]2([H])[C@@](CO)(C)C1
MCULE-9550944601 0.71 C12C(CCCC1=CC(=C(OC)C=2)C)=O
MCULE-2521303124 0.71 C12C(CCCC1=C(C=C(C)C=2C)OC)=O
MCULE-4984903837 0.71 C1(C(C)=CC(=C(C)C=1)OC)C(=O)CC(C)CC(C)(C)C
MCULE-3535588027 0.71 C1(C(C)=CC(=C(C)C=1)OC)C(C(CCCC)CC)=O
MCULE-6552616702 0.71 C12=C(CCCC1=O)C=CC(C1CCCCC1)=C2
MCULE-1449955674 0.71 O=C1CCCC2C3=CC=C(C=21)CCCCC1C=CC(CCCC3)=CC=1
MCULE-1750687881 0.71 C1=C2C([C@]3(C)[C@@]([H])(CC2)C(C)(C)CCC3)=CC(O)=C1C(C)C
MCULE-4743270025 0.71 C(CCCCCCCCC)(C1=CC=C(O)C(O)=C1O)=O
MCULE-1162163176 0.71 OC1=C2C(CCCC2)=CC(C=O)=C1
MCULE-7886488799 0.71 C1(C(CCCCCCCCC)=O)=CC(CCCCCC)=C(C=C1O)O
MCULE-2115940406 0.71 C1(C(CCCCCC)=O)=CC(CCCCCC)=C(C=C1O)O
MCULE-5045367038 0.71 C1(C(CCCCC)=O)=CC(CCCCCC)=C(C=C1O)O
MCULE-1825122879 0.71 OC1C(O)=C(O)C(C(=O)CCCCCCCC)=CC=1
MCULE-1320972086 0.71 C12C=CC(=CC=1CCCC2=O)OC
MCULE-1674163310 0.71 C12C(CCCC=1C=C(C(OC)=C2)OC)=O
MCULE-4625960564 0.71 C1C=C2CC(C(C(C)(C)C(=O)O)CC)CCC2=CC=1O
MCULE-8663843967 0.71 C1(=C(C(C)=C2CCC(=O)C2=C1)O)C
MolPort-000-139-955 0.71 COC1=CC=C2C(=O)CCCC2=C1
MolPort-001-793-340 0.71 COC1=C(OC)C=C2C(=O)CCCC2=C1
MolPort-042-644-315 0.71 CC1=CC2=C(CCC2=O)C(C)=C1O
MolPort-005-939-076 0.70 CCCCC(=O)C1=CC(O)=C(O)C=C1
MolPort-035-705-947 0.70 CC(C)C1=C(O)C=CC2=C1CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C
MolPort-020-002-885 0.70 CC(=O)C1=C(O)C2=C(CCCC2)C=C1
MolPort-046-764-497 0.70 C[C@]12CC[C@H]3[C@@H](CCC4=C(C(O)=O)C(O)=CC=C34)[C@@H]1CC[C@@H]2O
MolPort-044-561-252 0.70 C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1C[C@@H](O)C2=O
MolPort-046-766-070 0.70 [2H]C1=CC2=C(C([2H])=C1O)C([2H])([2H])C[C@H]1[C@@H]3CC(=O)[C@H](O)[C@@]3(C)CC[C@]21[2H]
MolPort-046-766-131 0.70 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC(=O)[C@@H]2O
MolPort-044-550-959 0.70 CCCCCCCCCCCC(=O)C1=C(O)C(C(=O)CCCCCCCCCCC)=C(O)C=C1O
MolPort-001-739-552 0.70 C[C@@H]1CC(=O)C2=C3C(=O)C4=CC=CC(O)=C4C(=O)C3=CC=C2C1
MolPort-044-560-299 0.70 CC1CC(=O)C2=C(C1)C=CC1=C2C(=O)C2=C(C(O)=CC=C2)C1=O
MolPort-001-785-609 0.70 COC1=CC2=C(CCCC2=O)C=C1
MCULE-7180865594 0.70 O=C1CCCCC2C(OC)=C(OC)C=CC=21
MCULE-1886866691 0.70 CCCCC(=O)C1C=C(O)C(O)=CC=1
MCULE-7312750466 0.70 C1(C(CCC2CCCC2)=O)C(C)=CC(=C(C)C=1)OC
MCULE-3310562773 0.70 C1(=C(C)C=C(C(C)=C1)OC)C(C1CCCC1)=O
MCULE-1860682261 0.70 C12CCCCC=1C(=CC=C2C=O)OC
MCULE-4756733403 0.70 C1C(O)=C(C(=O)CCCCCCCCCCC)C(O)=C(C(=O)CCCCCCCCCCC)C=1O
MCULE-8514226854 0.70 C(O)(=O)CC1(CC(F)(F)F)CCC2=C(C1=O)C=CC(O)=C2
MCULE-4796348641 0.70 CC1CC(=O)C2C3C(=O)C4C=CC=C(O)C=4C(=O)C=3C=CC=2C1
MCULE-1314771458 0.70 C1C=C2C(C(=O)C3=C(C2=O)C2C(=O)C[C@@H](C)CC=2C=C3)=C(O)C=1
MCULE-7247560626 0.70 COC1=CC2=C(CCCC2=O)C=C1
MCULE-2984863414 0.70 C1(C(C)=CC(=C(C)C=1)OC)C(C(CCC)CCC)=O
MCULE-5130339783 0.70 C1(=O)C(C=O)CCC2=CC(=CC=C12)OC
MCULE-7280126359 0.70 C12=CC=C(OC)C=C1CCC(C(=O)C)C2=O
MCULE-8353661709 0.70 O=C1C2C3=C(C=CC=2)CCCC3C1
MCULE-4507002336 0.70 C1CC2(C3C=CC(C(C)C)=CC=3C(CC2C(C(=O)O)(C)C1)=O)C
MCULE-1004016519 0.70 C12(C)CCC[C@@](C)(C(=O)OC)C1CCC1C=CC(O)=CC2=1
MCULE-9495693297 0.70 CC1C2=C(C=CC(O)=C2C(=O)C1)C
MCULE-5238810662 0.70 O=C1C2C=CC(=CC=2CCC1)OCC
MCULE-2150607106 0.70 O=C1C2C=CC(OC(C)C)=CC=2CCC1
MolPort-002-893-143 0.70 COC1=CC2=C(C=C1)C(=O)C(CC2)C(C)=O
MolPort-006-067-529 0.70 COC1=CC2=C(C=C1)C(=O)C(CC2)C=O
MolPort-016-566-788 0.70 O=C1CC2CCCC3=CC=CC1=C23
MolPort-001-741-121 0.70 CC(C)C1=CC2=C(C=C1)C1(C)CCCC(C)(C1CC2=O)C(O)=O
MolPort-002-471-246 0.70 CC1CC(=O)C2=C1C(C)=CC=C2O
MolPort-002-498-101 0.70 CC(C)OC1=CC=C2C(=O)CCCC2=C1
MolPort-028-745-331 0.69 COC(=O)CC1CCC2=C(C=CC(OC)=C2)C1=O
MolPort-046-763-910 0.69 COC1=CC2=C(C=C1)[C@@H]1CC[C@]3(C)[C@H](CC[C@@H]3[C@@H]1CC2=O)OC(C)=O
MCULE-4554061331 0.69 C1(C(C)(C)C)=CC(C2CCCCC2)=CC(C=O)=C1O
MCULE-8830180430 0.69 C1(=CC=C(C=C1C)O)C(CCC(O)=O)=O
MCULE-3608404009 0.69 C12C(O)=CC=C(C)C=1C(CC2)=O
MCULE-3021339741 0.69 O=C1C2C=CC=C(C)C=2CCC1
MCULE-9358077639 0.69 C1(=O)C2=C(C(OC)=C(OC)C=C2)CCC1
MCULE-4912228591 0.69 [C@]12(C)CC[C@]3([C@@]([H])(CCC4C=C(C(C(C)=O)=CC3=4)O)[C@]1([H])CC[C@@H]2OC(C)=O)[H]
MCULE-5698863664 0.69 C1(C(C)=CC(=C(C)C=1)OC)C(C(C)CCC)=O
MCULE-4552211970 0.69 C1(C(CCCC)=O)C(C)=CC(=C(C)C=1)OC
MCULE-3055669086 0.69 C12CCCCC1=C(C=O)C=C(C(=O)O)C=2O
MolPort-006-118-382 0.69 CC1=CC=CC2=C1CCCC2=O
MolPort-035-946-521 0.69 CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=C(C=C4[C@H]3CC[C@]12C)C(C)=O
MolPort-014-726-647 0.69 CCCCC1=CC2=C(CCCC2=O)C=C1
MolPort-008-492-490 0.69 CC(C)(C)C1=CC=C2CCCC(=O)C2=C1
MolPort-008-492-489 0.69 CC(C)C1=CC=C2CCCC(=O)C2=C1
MolPort-014-726-634 0.69 CCCC1=CC2=C(CCCC2=O)C=C1
MolPort-008-492-488 0.69 CCC1=CC2=C(CCCC2=O)C=C1
MolPort-014-726-644 0.69 CC(C)CC1=CC=C2CCCC(=O)C2=C1
MolPort-035-705-815 0.68 CC(C)C1=CC2=C(C=C1O)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC2
MolPort-039-141-765 0.68 CC(=O)[C@@H]1C2=C(C(=O)C[C@@]1(C)O)C(O)=CC(O)=C2
MolPort-039-141-764 0.68 CC(=O)[C@@H]1C2=C(C(=O)C[C@]1(C)O)C(O)=CC(O)=C2
MolPort-039-052-415 0.68 CC(C)C[C@@H](C1=C(O)C(C=O)=C(O)C(C=O)=C1O)[C@@]1(C)CCC(=O)[C@@H]1[C@H]1[C@@H](CCC(C)=O)C1(C)C
MolPort-035-706-256 0.68 CC(C)C[C@H](C1=C(O)C(C=O)=C(O)C(C=O)=C1O)[C@@]1(C)CCC(=O)[C@@H]1[C@H]1[C@@H](CCC(C)=O)C1(C)C
MolPort-028-851-347 0.68 CCCCCCC1=CC(C(C)=O)=C(O)C=C1
MolPort-008-492-487 0.68 CC1=CC=C(C)C2=C1CCCC2=O
MolPort-003-009-893 0.68 OC1=CC(C2CCCCC2)=C(C=C1C1CCCCC1)C1CCCCC1
MCULE-9121591562 0.68 CC(C1=CC2=C(CCCC2=O)C=C1)(C)C
MCULE-7557394706 0.68 C12C=C(CCCC)C=CC=1CCCC2=O
MCULE-6584987606 0.68 C12=C(CCCC1=O)C=CC(CC(C)C)=C2
MCULE-8208230530 0.68 CC(C1=CC2=C(CCCC2=O)C=C1)C
MCULE-2774372059 0.68 C12=CC(CC)=CC=C1CCCC2=O
MCULE-7494257850 0.68 C1(O)C2=CC=CC=C2C=C(CCCC)C=1C(C)=O
MCULE-3524695450 0.68 C12C=C(CCC)C=CC=1CCCC2=O
MCULE-9255159027 0.68 C1C(O)=C2C(=O)C[C@@](O)(C)[C@H](C(C)=O)C2=CC=1O
MCULE-1961018349 0.68 O=C(CCCCC)C1C(O)=C(C)C(O)=CC=1
MCULE-5387016398 0.68 C(CCCCCCCC)(C1C=CC(O)=C(C)C=1O)=O
MCULE-4249997598 0.68 C1C(O)=C2C(=O)C[C@@](C)(O)[C@H](C(C)=O)C2=CC=1O
MCULE-3080774256 0.68 C(CCCCCC)(C1C=CC(O)=C(C)C=1O)=O
MCULE-3207636917 0.68 C1(=O)C2=C(C(C)=CC=C2O)CC1
MCULE-2246378289 0.68 C12=C(C)C=CC(C)=C1CCCC2=O
MCULE-8599495965 0.68 C1(C(C)(C)C)C(O)=C(C(C)(C)C)C=C(C(C2CC2)=O)C=1
MCULE-3148876728 0.68 C1(C=C(CCCCCC)C=CC=1O)C(C)=O
MCULE-2748521288 0.68 C1(C2CCCCC2)=CC(C2CCCCC2)=C(C=C1C1CCCCC1)O
MCULE-8144239811 0.68 C1(C=CC(=CC=1C)OC)C(C1CCCCC1)=O
MCULE-4979218316 0.68 C(CC(=O)C(C)(C)C)(C1C=CC(OC)=CC=1)C1CCC2C=CC=CC=2C1=O
MCULE-8621618686 0.68 C1(=C(C)C=C(C(C)=C1)OC)C(C1CCC1)=O
MCULE-6247188993 0.68 C12(CCC(=O)CC1)C(=O)C1C(=CC(OC)=CC=1)C2
MCULE-1336332915 0.68 O=C1C2C=CC(=C(OC)C=2CCC1)C
MCULE-5561392761 0.68 C12=CC=C(O)C(F)=C1CCCCC2=O
MCULE-7002475500 0.68 C(OC1=CC=C2C(=O)CCCCC2=C1)(=O)C(C)(C)C
MCULE-2208310875 0.68 C1C(C)=C2C(=O)CCCC2=CC=1
MCULE-8459268816 0.68 C1(=O)CC2(CCCCC2)CC2C=CC=CC1=2
MCULE-6236653214 0.68 C1=CC2C3(C)CCCCC3(C)CC(=O)C=2C=C1
MCULE-6942394103 0.68 C1C=C2C3([H])CCCCC3CC(=O)C2=CC=1
MCULE-8639543648 0.68 C(=O)(C1=C2C(CCCC2)=CC=C1)C
MCULE-7773231978 0.68 C1(C=C(C)C=CC=1O)C(C(CCCC)CC)=O
MCULE-6916463977 0.68 C1(=CC(=CC=C1O)C)C(CCCCC(=O)C1=CC(=CC=C1O)C)=O
MCULE-7274979092 0.68 C1(=CC(C)=CC=C1O)C(CCCCCCC(=O)C1=CC(C)=CC=C1O)=O
MCULE-2631918402 0.68 C1(=CC(C)=CC=C1O)C(CCCCCCCCCCC(=O)C1=CC(C)=CC=C1O)=O
MCULE-5600210214 0.68 C1(C=C(C)C=CC=1O)C(CCCCCCCCCCCCC)=O
MCULE-8990776504 0.68 C1(C)=C(C)C(CCCC(O)=O)=CC(O)=C1O
MCULE-7718355790 0.68 C1(=CC(C)=CC=C1O)C(CCCCCCC)=O
MCULE-7356790854 0.68 C1(C=C(C)C=CC=1O)C(CCCCCCCCCCC)=O
MCULE-9748396239 0.68 C1(C=C(C)C=CC=1O)C(CCCCCCCCCCCCCCC)=O
MCULE-7838557158 0.68 C1(C=C(C)C=CC=1O)C(CCCCCCCCC)=O
MCULE-8927450348 0.68 C1(=CC(C)=CC=C1O)C(CCCCCCCCCC)=O
MCULE-6983531012 0.68 C12C(CCCC1=CC1=C(CCCC1)C=2)=O
MCULE-3870471679 0.68 C12CCCC1=CC1CCCCC(=O)C=1C=2
MolPort-006-129-282 0.68 CC1=CC=CC2=C1C(=O)CCC2
MolPort-001-836-725 0.68 O=C1CC2(CCCCC2)CC2=C1C=CC=C2
MolPort-022-880-060 0.68 O=C1CCCC2=CC3=C(CCCC3)C=C12
MolPort-037-686-196 0.68 CC1=C(O)C(O)=CC(CCCC(O)=O)=C1C
MolPort-002-911-145 0.67 COC1=CC2=C(C=C1C)C1CCC3(C)C(CCC3=O)C1CC2
MolPort-001-835-194 0.67 O=C1CCCC2=CC=C(OC3=CC=CC=C3)C=C12
MolPort-003-987-551 0.67 COC1=CC2=C(C=C1)C(=O)C(CC2)C1=CC=CC=C1
MolPort-022-398-788 0.67 CC1=C(CCO)C(C)=C(O)C2=C1C(=O)C(C)(C)C2
MolPort-009-194-650 0.67 OC1=CC=C2CCC(=O)C2=C1CC=C
MolPort-039-052-390 0.67 COC1=CC(=CC=C1O)[C@H]1[C@H](C)[C@H](C)C(=O)C2=CC(O)=C(OC)C=C12
MolPort-001-768-845 0.67 CC1=CC(C)=C2CCCC(=O)C2=C1
MolPort-008-492-504 0.67 CC1=CC2=C(C=C1)C(C)(C)CCC2=O
MolPort-046-146-544 0.67 CCCCCC(=O)C1=C(O)C=CC(CCC(O)=O)=C1
MolPort-019-846-903 0.67 COC1=C(O)C(=CC(C=O)=C1)C12CC3CC(CC(C3)C1)C2
MCULE-8366183024 0.67 C12C(=O)CCCC=1C=CC(OC1C=CC=CC=1)=C2
MCULE-6581463668 0.67 C12CCC3C=C(C(C)=CC=3C1CCC1(C)C(CCC21)=O)OC
MCULE-7869492567 0.67 O=C1C2C=CC(=CC=2CCC1C1C=CC=CC=1)OC
MCULE-2499530286 0.67 C12=C(C=CC(O)=C1CC=C)CCC2=O
MCULE-7094598899 0.67 C1(O)C=C2C(=O)[C@@H](C)[C@@H](C)[C@H](C3C=C(OC)C(O)=CC=3)C2=CC=1OC
MCULE-7931398952 0.67 C12(CC3CC(CC(C3)C1)C2)C1C=C(C=CC=1O)C=O
MCULE-8703176111 0.67 CC1=CC2=C(CCCC2=O)C(C)=C1
MCULE-2356504029 0.67 C1(=C(C23CC4CC(C2)CC(C4)C3)C=C(C=C1OC)C=O)O
MCULE-4596862433 0.67 C(OCC)(=O)CC1(C)CCC2=C(C1=O)C=CC(OC)=C2
MCULE-9108417216 0.67 C(OC1=CC=C2CCCCC(=O)C2=C1)(=O)C(C)(C)C
MCULE-9977573437 0.67 C(OCC)(=O)CC1CCC2=C(C1=O)C=CC(OC)=C2
MCULE-5946550944 0.67 C1(=CC(O)=CC=C1O)C(CCCCCCCCCC)=O
MCULE-5851600059 0.67 C1(=CC(O)=CC=C1O)C(CCCCCCCCCCC)=O
MCULE-2002938347 0.67 C12C=CC=C(OC)C=1CCCC2=O
MCULE-4048610533 0.67 C1(C(O)=O)C2CCCCC=2C=C(C(O)=O)C=1O
MCULE-4408147710 0.67 OC1=C(O)C2=C(C(CC2)=O)C=C1
MCULE-4838507999 0.67 C1(C=C(C)C(=C(C)C=1)OC)C(C1CCCCC1)=O
MCULE-4429858720 0.67 C1(=CC(=CC=C1O)O)C(CCCCCCC)=O
MCULE-9251611973 0.67 C12CCC3C=C(C=CC=3C1C(O)CC1(C)C(CCC21)=O)O
MCULE-5393759286 0.67 C1(O)C=C2C(=O)[C@@H](C)[C@@H](C)[C@H](C3C=C(OC)C(OC)=CC=3)C2=CC=1OC
MCULE-8263916464 0.67 C1(=CC(=CC=C1O)O)C(CCCCC)=O
MCULE-8240553518 0.67 C1C(O)=C(C(=O)CCCCCCCCCCCCC)C=C(O)C=1
MCULE-5042923862 0.67 C1C[C@]2(C)C3C=CC(C(C)=O)=CC=3CC[C@@]2([H])[C@](C)(C(=O)O)C1
MCULE-5775421145 0.67 C1(C=CC(=C(C)C=1)OC)C(C1CCCCC1)=O
MCULE-9214430462 0.67 C1(=CC(=CC=C1O)O)C(CCCCCC)=O
MCULE-7348477628 0.67 C(=O)(CC(C)CC(C)(C)C)C1C=CC(=CC=1C)OC
MCULE-3663981890 0.67 C1(C=CC(=CC=1C)OC)C(C(CCCC)CC)=O
MCULE-3549776581 0.67 C1=C(O)C=C2CC(C)C(=O)C2=C1
MCULE-4654726652 0.67 C1(=CC(=CC=C1O)O)C(CCCCCCCC)=O
MCULE-8014277137 0.67 OC1C=C2C(C(CC2)=O)=CC=1O
MCULE-4324010460 0.67 C1(=CC(O)=CC=C1O)C(CCCCCCCCCCC(=O)C1=CC(O)=CC=C1O)=O
MCULE-1272262650 0.67 C1(=CC(O)=CC=C1O)C(CCCCCCCCC)=O
MCULE-5585520867 0.67 [C@@]12(C)C(=O)CC[C@@]1([H])C1([C@@]([H])(C3C=CC(=CC=3CC1)O)[C@@H](O)C2)[H]
MCULE-2942285718 0.67 C12(CC3CC(CC(C3)C1)C2)C1C=CC(=C(C=O)C=1)O
MolPort-046-690-453 0.67 CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@H]21
MolPort-001-793-689 0.67 COC1=CC=CC2=C1CCCC2=O
MolPort-023-231-620 0.67 OC1=CC=C2C(=O)CCC2=C1O
MolPort-002-719-115 0.67 OC1=C(C=O)C=C(C=C1)C12CC3CC(CC(C3)C1)C2
MolPort-023-330-007 0.67 OC1=C(O)C=C2C(=O)CCC2=C1
MolPort-007-559-787 0.67 C[C@]12C[C@H](O)[C@H]3C(CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
MolPort-046-766-098 0.67 CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@@H](O)[C@@]3(C)CC[C@H]21
MolPort-035-757-065 0.67 C[C@]12C[C@@H](O)[C@H]3C(CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
MolPort-039-338-430 0.67 CC(=O)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@](C)([C@@H]1CC2)C(O)=O
MolPort-039-338-747 0.67 COC1=CC=C(C=C1OC)[C@H]1[C@H](C)[C@H](C)C(=O)C2=CC(O)=C(OC)C=C12
MolPort-003-847-942 0.66 C[C@@H]1CCC2=C(C1)C=CC1=C2C(=O)C2=C(C(O)=CC=C2)C1=O
MolPort-003-991-318 0.66 CCOC1=CC=C(C=O)C2=C1CCCC2
MolPort-046-158-450 0.66 O[C@@H]1CCC(=O)C2=C1C=CC=C2O
MolPort-035-705-842 0.66 CC(C)(O)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@@](C)(CO)[C@@H]1CC2=O
MolPort-046-690-031 0.66 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CC[C@@H]2O
MolPort-006-393-738 0.66 CCCC(=O)C1=CC(O)=C(O)C=C1
MolPort-046-792-954 0.66 C[C@]12CC[C@@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@H]1CC[C@@H]2O
MolPort-002-952-522 0.66 CC1=C2CCCCC2=CC=C1O
MCULE-3739965645 0.66 O=C1C2C(O)=C3CC(CCC3=C(O)C=2C(C2C=CC=CC=21)=O)C(C)=O
MCULE-5078918595 0.66 C(OC1=CC=C2C(=C1)CCCC2=O)(=O)C(C)(C)C
MCULE-3603642788 0.66 C12CCCCC=1C(=CC=C2C=O)OCC
MCULE-8829445833 0.66 C1(C(C)=O)=CC2CCCCC=2C(C)=C1OC
MCULE-5548559598 0.66 C1C[C@]2(C)C3C=CC(C(O)(C)C)=CC=3C(=O)C[C@H]2[C@@](CO)(C)C1
MCULE-3380616550 0.66 C1(C(O)=O)=CC2CCCCC=2C(C)=C1O
MCULE-4552793396 0.66 C1C(O)=C(C(=O)CCC(C2C=C(C)C=CC=2O)=O)C=C(C)C=1
MCULE-4139371390 0.66 O=C1CC(C)(C)CC2C=C(C)C=C(C)C=21
MCULE-3362721900 0.66 C1(=CC=CC(C)=C1O)C(CCCCCCCCCCC)=O
MCULE-8050973931 0.66 C1(=CC=CC(C)=C1O)C(CCCCCCCCCC)=O
MCULE-4686455721 0.66 C1(C=CC(=C(O)C=1)O)C(CCC)=O
MCULE-6080429821 0.66 C1(C(C2CCCCC2)=O)=CC=CC(C)=C1C
MCULE-3458089101 0.66 C12CCCCC=1C=CC(O)=C2C
MCULE-7140905409 0.66 C12=C(C)C=C(O)C=C1C(C)(C)CCC2(C)C
MCULE-1978161922 0.66 COC1=CC=C2C(CC(C3=CC=CC=C3)CC2=O)=C1OC
MCULE-4482431974 0.66 COC1C=C(C)C(C(CCCCCCCCCO)=O)=C(O)C=1OC
MCULE-5391364212 0.66 C1(OC)C=C2C(=O)[C@@H](C)[C@@H](C)[C@H](C3C=C(OC)C(OC)=CC=3)C2=CC=1OC
MCULE-6490054319 0.66 C1(OC)C=C2C(=O)[C@@H](C)[C@@H](C)[C@H](C3C=CC(O)=C(OC)C=3)C2=CC=1OC
MCULE-6893254039 0.66 C12CCC3C(C)=CC=C(OC)C=3C1CCC1(C)C(CCC21)=O
MCULE-8150629240 0.66 C1(C=CC(=CC=1C)OC)C(C1CCCC1)=O
MCULE-1631157853 0.66 O=C1CCCC2C1CCC1C2CCC2C=C(OC)C=CC=21
MCULE-4070673377 0.66 C(=O)(C1CCCCC1C(O)=O)C1C=C(C)C=CC=1O
MCULE-3155242910 0.66 C1(C(C)=O)C=C(C)C2=C(CCC2)C=1O
MCULE-4016556702 0.66 C1(C=CC(=CC=1C)OC)C(CCC1CCCC1)=O
MCULE-7300960291 0.66 C1(C(C)=O)=CC(CCCCCC)=C(C=C1O)O
MCULE-4851256769 0.66 O=C1CCCC2C=CC(C)=CC=21
MCULE-6774473542 0.66 CC(C(O)=O)(OC1=CC2=C(C(CCC2)=O)C=C1)C
MCULE-1436569228 0.66 C1(C(CCCCC(OC)=O)=O)C(C)=CC(=C(C)C=1)OC
MCULE-9189569750 0.66 C1(C(CCCCCBr)=O)C(C)=CC(=C(C)C=1)OC
MolPort-046-591-284 0.66 COC1=C(OC)C2=C(C=C1)C(=O)CC(C2)C1=CC=CC=C1
MolPort-044-754-138 0.66 COC1=CC=C(C=C1OC)[C@H]1[C@H](C)[C@H](C)C(=O)C2=CC(OC)=C(OC)C=C12
MolPort-039-339-055 0.66 COC1=C(O)C=CC(=C1)[C@H]1[C@H](C)[C@H](C)C(=O)C2=CC(OC)=C(OC)C=C12
MolPort-023-333-017 0.66 COC1=C(OC)C(O)=C(C(=O)CCCCCCCCCO)C(C)=C1
MolPort-002-911-156 0.66 COC1=CC=C(C)C2=C1C1CCC3(C)C(CCC3=O)C1CC2
MolPort-002-511-955 0.66 CC(=O)C1=C(O)C2=C(CCC2)C(C)=C1
MolPort-002-499-619 0.66 OC(=O)C1CCC2=CC=C(O)C=C2C1
MolPort-044-723-239 0.66 CC1=CC2=C(C=C1O)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC2
MolPort-001-785-984 0.66 CC1=CC2=C(CCCC2=O)C=C1
MolPort-001-761-989 0.66 CCCCCCC1=C(O)C=C(O)C(=C1)C(C)=O
MolPort-002-806-651 0.66 CC1(C)C2CCC1[C@H](C2)OC1CC(=O)CC2C1C(=O)C1=C(C=CC=C1O)C2=O
MolPort-011-721-173 0.66 CC(C)(OC1=CC2=C(C=C1)C(=O)CCC2)C(O)=O
MolPort-003-958-797 0.65 COC1=CC2=C(CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@H]23)C=C1O
MolPort-001-762-007 0.65 CCCC1=CC=C(O)C(=C1)C(=O)CCC(O)=O
MolPort-046-793-299 0.65 C[C@]12CC[C@@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@H]1CC[C@@H]2O
MolPort-000-489-141 0.65 CC1CC(=O)C2=C1C=C(O)C=C2
MolPort-039-138-933 0.65 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@@H]1CC[C@@H]2O
MolPort-002-884-132 0.65 CCCCCCCCC1=CC(C=O)=C(O)C=C1
MolPort-002-513-430 0.65 O=C1CCCC2=CC3=C(OCCO3)C=C12
MolPort-004-787-161 0.65 OC(=O)C1=C2CCC(=O)C2=C(O)C(O)=C1
MolPort-044-637-562 0.65 CC1=CC(O)=CC2=CC3=C(C(=O)CC[C@@H]3O)C(O)=C12
MolPort-016-634-607 0.65 OC(=O)C1=CC2=C(CCCC2)C=C1O
MCULE-6109769732 0.65 C1(C(CCC(O)=O)=O)=C(C)C=C(OC)C(C)=C1
MCULE-6110399304 0.65 C12(C)CCC3C(CCC4C=C(OCC(C)C)C=CC3=4)C1CCC2=O
MCULE-5135545346 0.65 C12(C)CCC3C(CCC4C=C(OCCC)C=CC3=4)C1CCC2=O
MCULE-4939758047 0.65 [C@]12([H])CC[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CCC1C=C(O)C(OC)=CC2=1)=O
MCULE-8453201212 0.65 C(=O)(CC(C)CC(C)(C)C)C1=CC=C(OC)C(C)=C1
MCULE-5590176754 0.65 C1(C=CC(=CC=1C)OC)C(C(CCC)CCC)=O
MCULE-3662339007 0.65 C1(=CC=C(OC)C(C)=C1)C(C(CCCC)CC)=O
MCULE-4083177447 0.65 C1(=CC(CCC)=CC=C1O)C(CCC(O)=O)=O
MCULE-5961479684 0.65 C1(C=C(C)C(=C(C)C=1)OC)C(=O)CC(C)CC(C)(C)C
MCULE-1059581285 0.65 C1(C=C(C)C(=C(C)C=1)OC)C(C(CCCC)CC)=O
MCULE-7397366959 0.65 C1(=CC(CC)=CC=C1O)C(CCC(O)=O)=O
MCULE-5915318189 0.65 C1(C(CCC(O)=O)=O)C=C(C)C(=C(C)C=1)O
MCULE-7215096855 0.65 C[C@]12CC[C@@]3([H])[C@](CCC4C=C(O)C(O)=CC=43)([H])[C@]1([H])CC[C@@H]2O
MCULE-8816003018 0.65 C12C=C(O)C=CC=1C(CC2C)=O
MCULE-6829870069 0.65 C1(C(C)=C(C)C=C(C)C=1C)C(C1CCCCC1)=O
MCULE-2946004260 0.65 C1(C(C2CCCCC2)=O)=CC(C)=CC=C1C
MCULE-6630638936 0.65 C1(C=O)C=C(CCCCCCCC)C=CC=1O
MCULE-2736057224 0.65 O=C1C2CCC(C)(C2=O)C2C=C(OC)C=CC=21
MCULE-2455092132 0.65 O=C1C2C=C(OC)C=CC=2CC(CC1)C(O)=O
MCULE-5594412134 0.65 C12C(CCCC1=CC1=C(OCCO1)C=2)=O
MCULE-5887410327 0.65 C1(=O)C2=C(C(C(O)=O)=CC(O)=C2O)CC1
MCULE-4822181774 0.65 C1(O)C=C2C=C3[C@@H](O)CCC(=O)C3=C(O)C2=C(C)C=1
MCULE-3519586848 0.65 C1(CCC(=O)O)(CCC(=O)O)C(=O)C2C(=CC(OC)=CC=2)C1
MCULE-1591574086 0.65 OC(C1=C(O)C=C2C(CCCC2)=C1)=O
MCULE-4620278870 0.65 [C@]12(C)CC[C@]3([C@@]([H])(CCC4C=C(OC)C=CC3=4)[C@]1([H])CCC2=O)[H]
MCULE-8004509337 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(=O)CC(C)C
MCULE-5442899168 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(=O)C(C)(C)CC
MCULE-3641533673 0.65 C1(C(CCC)=O)C(C)=CC(=C(C)C=1)OC
MCULE-2100239759 0.65 C12(C)CCC3C(CCC4C=C(OC)C=CC3=4)C1CCC2=O
MCULE-5580257166 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(C(CC)CC)=O
MCULE-9544290428 0.65 [C@]12(C)CC[C@]3([C@@]([H])(CCC4C=C(OC)C=CC3=4)[C@]1([H])CCC2=O)[H]
MCULE-3914995441 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(C(C)CC)=O
MCULE-9559141010 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(=O)CC(C)(C)C
MCULE-2318207290 0.65 C1CC2C=CC3CCC(=O)C=3C=2CC1
MCULE-8785123450 0.65 C12C(CCCC1=CC(=C(C)C=2)C)=O
MCULE-3718202125 0.65 C12CCCCC1=C(C=O)C=C1CCCCC=21
MCULE-2344405396 0.65 C1=CC2C3CCCC(=O)C=3C=C(C)C=2C=C1
MCULE-1909922837 0.65 C12(CC3CC(CC(C3)C1)C2)C1=CC(=CC(C=O)=C1O)C
MCULE-9659403532 0.65 C1(=CC(C)=CC=C1O)C(CCCC)=O
MCULE-7628388928 0.65 C1(=CC(C)=CC(C)=C1O)C(CCCC)=O
MCULE-4038363220 0.65 C1C=C(CCC(O)CC(=O)C2C=CC(O)=CC=2)C=CC=1
MCULE-4846742606 0.65 C12(CCC(=O)C(C(=O)O)C1)C(=O)C1=CC=C(C=C1C2)OC
MCULE-2464779241 0.65 C1(C=CC=C(C)C=1C)C(C(CCCC)CC)=O
MCULE-3099591535 0.65 C1(C=CC=C(C)C=1C)C(CCCCCCC)=O
MCULE-3957388694 0.65 CCCCCCCC(C1=CC=C(O)C=C1)=O
MCULE-7842885035 0.65 CCCCCCCCCCCC(C1=CC=C(O)C=C1)=O
MCULE-5707235785 0.65 C(CCCCCCCCCCCCCCC)(C1C=CC(O)=CC=1)=O
MCULE-2870759954 0.65 C(CCCCCCCCCCCCC)(=O)C1C=CC(=CC=1)O
MCULE-9776464583 0.65 C1(C=CC=C(C)C=1C)C(CCCCCCCCCCCCC)=O
MCULE-4059787297 0.65 C(CCCCCCCC)(C1=CC=C(O)C=C1)=O
MCULE-4125104827 0.65 C1(C=CC=C(C)C=1C)C(CCCCC)=O
MCULE-2684379026 0.65 C1=C(O)C=CC(C(=O)CCCCCCCCC)=C1
MCULE-8748137964 0.65 C1C=C(C=CC=1O)C(=O)CCCCCC
MCULE-4270753904 0.65 C1(C=CC=C(C)C=1C)C(CCCCCC)=O
MCULE-1750323566 0.65 C1(C=CC=C(C)C=1C)C(CCCCCCCC)=O
MCULE-6377241928 0.65 C(=O)(CC(C)CC(C)(C)C)C1C=CC=C(C)C=1C
MCULE-3556387069 0.65 C1(C=CC=C(C)C=1C)C(CCCCCCCCCCC)=O
MCULE-1644617578 0.65 C1(C=CC=C(C)C=1C)C(CCCCCCCCC)=O
MCULE-7909700667 0.65 C1C=C(C(=O)CCCCC)C=CC=1O
MCULE-1272691262 0.65 C12C=CC(OC)=CC=1C(=O)CCC2C1C=CC=CC=1
MCULE-8757134456 0.65 C1C[C@]2(C)C3C=CC(C(O)(C)C)=CC=3C(=O)C[C@@]2([H])[C@@](O)(C)C1
MCULE-7907400019 0.65 C1C[C@]2([C@]([H])([C@@](C(O)=O)(C)C1)CC(=O)C1C=C(C=CC2=1)C(O)(C)C)C
MCULE-9829706481 0.65 C12=C(C=CC=C1OC)CCCC2=O
MCULE-4323145673 0.65 C1(C)C2CCCCC=2C=C(C=O)C=1OC
MCULE-1444445957 0.65 C1(=CC=C(OC)C(OC)=C1)C(C1CCCCC1)=O
MCULE-5590432343 0.65 C1(=O)C2=CC(OC)=C(C=C2CCC1C(OC)=O)OC
MCULE-1832280119 0.65 C1(C=CC(=C(C)C=1)OC)C(C1CCCC1)=O
MCULE-4141924500 0.65 C1(=CC(C)=C(C(C)=C1)OC)C(C1CCCC1)=O
MCULE-4359949498 0.65 C12=CC(O)=C(C=C1CCC1=C(C=CC=C1)CC2=O)O
MCULE-3191209499 0.65 C1(=CC=C(OC)C(C)=C1)C(CCC1CCCC1)=O
MCULE-9080997199 0.65 C1(C(CCC2CCCC2)=O)C=C(C)C(=C(C)C=1)OC
MCULE-9963608087 0.65 C1(C)(CCC2C(=CC=C(OC)C=2)C1=O)C(OC)=O
MCULE-2500340214 0.65 C1(OC)C(OC)=C(OC)C=C2CCCC(=O)C=12
MCULE-4716042972 0.65 C1(CCC2C(=CC=C(OC)C=2)C1=O)C(OC)=O
MolPort-004-964-898 0.65 COC1=CC2=C(C=C1)[C@H]1CC[C@@]3(C)[C@@H](CCC3=O)[C@@H]1CC2
MolPort-002-525-946 0.65 COC1=CC2=C(C=C1)C1CC[C@@]3(C)C(CCC3=O)[C@@H]1CC2
MolPort-046-793-224 0.65 [2H]C1([2H])[C@H]2[C@@H]3CCC(=O)[C@@]3(C)CC[C@]2([2H])C2=CC=C(OC)C=C2C1([2H])[2H]
MolPort-039-338-761 0.65 CC(C)(O)C1=CC2=C(C=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2
MolPort-001-785-940 0.65 COC1=CC2=C(C=C1)C1CCC3(C)C(CCC3=O)C1CC2
MolPort-046-195-530 0.65 O=C1CCC2=CC=C3CCCCC3=C12
MolPort-015-142-632 0.65 CC1=CC(=C(O)C(C=O)=C1)C12CC3CC(CC(C3)C1)C2
MolPort-039-338-818 0.65 OC(CCC1=CC=CC=C1)CC(=O)C1=CC=C(O)C=C1
MolPort-001-845-511 0.65 CC1=C(C)C=C2C(=O)CCCC2=C1
MolPort-001-496-414 0.65 O=CC1=C2CCCCC2=C2CCCCC2=C1
MolPort-001-768-141 0.65 CCCCCCCCCCCC(=O)C1=CC=C(O)C=C1
MolPort-000-183-587 0.65 CCCCCCC(=O)C1=CC=C(O)C=C1
MolPort-000-183-588 0.65 CCCCCCCC(=O)C1=CC=C(O)C=C1
MolPort-030-902-330 0.65 CCCCCCC(=O)C1=CC=CC(C)=C1C
MolPort-030-902-329 0.65 CCCCCC(=O)C1=CC=CC(C)=C1C
MolPort-022-369-275 0.65 O=CC1=C2CCCCC2=CC=C1
MolPort-002-120-963 0.65 COC1=CC2=C(C=C1)C(CCC2=O)C1=CC=CC=C1
MolPort-046-736-627 0.65 OC1=CC=C2CC3CCCCC3CC2=C1
MolPort-001-740-915 0.65 CC(C)(O)C1=CC=C2C(=C1)C(=O)C[C@H]1[C@@](C)(CCC[C@]21C)C(O)=O
MolPort-016-578-769 0.65 COC1=C2C(=O)CCCC2=CC=C1
MolPort-003-803-452 0.65 COC1=C(C)C2=C(CC[C@@H](C2)C(C)C(O)=O)C(C)=C1
MolPort-046-690-375 0.65 [2H][13C]([2H])([2H])OC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC[C@H]21
MolPort-035-705-844 0.65 CC(C)(O)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@@](C)(O)[C@@H]1CC2=O
MolPort-046-690-374 0.65 COC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC[C@H]21
MolPort-044-831-589 0.65 COC(=O)C1CCC2=C(C=C(OC)C(OC)=C2)C1=O
MolPort-035-775-368 0.65 COC(=O)C1CCC2=CC(OC)=CC=C2C1=O
MolPort-002-841-844 0.65 COC(=O)C1(C)CCC2=CC(OC)=CC=C2C1=O
MolPort-001-787-752 0.64 OC(=O)CC1CCC2=C(C=CC=C2)C1=O
MolPort-002-133-779 0.64 CCCCCCC1=CC(C=O)=C(O)C=C1O
MolPort-022-879-480 0.64 O=C1C2CCC(C2)C2=C1C=CC=C2
MolPort-002-498-635 0.64 COC1=CC=C(C=C1OC)C(=O)[C@H]1CCCC[C@H]1C(O)=O
MolPort-044-724-411 0.64 C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CCC2OC(=O)CCC1CCCC1
MolPort-003-941-327 0.64 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
MolPort-003-666-182 0.64 C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CC[C@@H]2OC(=O)CCC1CCCC1
MolPort-006-116-546 0.64 CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12C
MolPort-002-806-648 0.64 CC(C)(C)OC1CC(O)CC2C1C(=O)C1=C(C(O)=CC=C1O)C2=O
MolPort-046-686-371 0.64 CCCCCCCCCC(=O)C1=CC(C(O)=O)=C(O)C=C1
MolPort-039-141-950 0.64 CCCCCCCC(=O)C1=CC(C(O)=O)=C(O)C=C1
MolPort-046-701-759 0.64 CC(C)C1=CC2=C(C(O)=C1O)C1(CCCC(C)(C)C1CC2)C(O)=O
MolPort-005-943-409 0.64 CC(C)C1=C(O)C(O)=C2C(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)=C1
MolPort-003-941-332 0.64 C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@H]2O
MolPort-002-911-125 0.64 CC1CC2(C)C(O)CCC2C2CCC3=C(C=CC(O)=C3)C12
MolPort-003-941-281 0.64 [2H]C1=CC2=C(CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)CC[C@H]23)C([2H])=C1O
MolPort-000-720-875 0.64 CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2O
MolPort-003-803-198 0.64 OC1=CC2=C(CCC2=O)C=C1
MolPort-002-546-678 0.64 CC(C)(C)C1=CC(CC2C(=O)CC(C)(C)CC2=O)=CC(=C1O)C(C)(C)C
MolPort-006-318-980 0.64 C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2O
MolPort-001-794-632 0.64 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2O
MolPort-001-740-064 0.64 C[C@]12CCC3[C@@H](CCC4=C3C=CC(O)=C4)C1CC[C@H]2O
MolPort-003-847-099 0.64 [2H]C1([2H])C[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]2(C)[C@@]1([2H])O
MolPort-001-759-825 0.64 OC1=CC=C2C(=O)CCC2=C1
MolPort-009-018-993 0.64 CCC1(O)CCC2[C@@H]3CCC4=CC(O)=CC=C4C3CC[C@]12C
MolPort-008-750-601 0.64 OC(=O)CCC(=O)C1=CC(O)=CC=C1
MolPort-046-766-129 0.64 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C(CCCCCCCCCC1CC2=C(C=CC(O)=C2)[C@H]2CC[C@]4(C)[C@@H](O)CC[C@H]4[C@H]12)CC1=CC(O)=CC=C31
MCULE-3040340273 0.64 O=C1C(C(CC(C2C=CC=C(CC)C=2)=O)C2C=CC=CC=2)C(C2C=CC=CC=21)=O
MCULE-6180503291 0.64 C1(=CC(C)=CC=C1O)C(CCCCCCCCCCC(O)=O)=O
MCULE-4455219361 0.64 C1(C=CC(=CC=1C)OC)C(C(C)CCC)=O
MCULE-2232499968 0.64 C1(C(CCCCCC)=O)C(O)=CC(=C(O)C=1)C
MCULE-7062176248 0.64 C1(C(CCCC)=O)C=CC(=CC=1C)OC
MCULE-2400405566 0.64 O=C1C2C=C(C=CC=2CCC1)CC1C=CC=CC=1
MCULE-9061727220 0.64 C1(=CC(C)=CC=C1O)C(CCCCCCC(O)=O)=O
MCULE-1213217702 0.64 C1(=CC(=CC=C1O)O)C(CCCC)=O
MCULE-2217552374 0.64 C1C=C2[C@@]3([H])CC[C@]4(C)[C@@H](O)CC[C@@]4([H])[C@]3([H])CCC2=CC=1O
MCULE-1428597456 0.64 C1CC(C(=O)C2C(CC)=CC=CC=2)CCC1C(=O)O
MCULE-6631914782 0.64 C1(CC2=CC(C(C)(C)C)=C(C(C(C)(C)C)=C2)O)C(=O)CC(CC1=O)(C)C
MCULE-5421157613 0.64 C1(=O)C2=C(C=CC(O)=C2)CC1
MCULE-8556154037 0.64 C1(=O)C2=CC=CC=C2CC2CCCC(=O)C12
MCULE-1095311163 0.64 C1(=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](O)CC3)CC2)O
MCULE-6919861260 0.64 C12=CC=C(C=C1CCC2=O)O
MCULE-1304124190 0.64 [C@@]12([H])CC[C@@H](O)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
MCULE-3071562168 0.64 C(CCC(O)=O)(=O)C1=CC=CC(O)=C1
MCULE-2655267349 0.64 CC1=C2[C@H]3C(C)(C)[C@H]3CCC(=C)C2=C2C(C[C@H](C2=O)C)=C1O
MCULE-4388835078 0.64 C12CCC3C=C(C=CC=3C1C(C)CC1(C)C(CCC21)O)O
MCULE-1811071576 0.64 [C@@]12([H])CC[C@@H](O)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
MCULE-5730716948 0.64 C1CC(C(=O)C2C(C(C)C)=CC=CC=2)CCC1C(=O)O
MCULE-9777047906 0.64 C12(C)C(O)CCC1C1C(C3=CC=C(C=C3CC1)O)CC2
MCULE-8637968727 0.64 C1(C(=O)CCC2C(C)=CC(=C(C(C)C)C=2)OC)=C(C)C=C(C(C(C)C)=C1)OC
MCULE-1655795379 0.64 C1(=CC(=CC=C1C)C)C(CCCCCCCC)=O
MCULE-2560740449 0.64 C12(C3=C(C=CC=C3)C(=O)CC1)CC2
MCULE-8600456158 0.64 CC1C(C)=C(C(C2C3(CC3)C2)=O)C=CC=1
MCULE-3876369366 0.64 C1(=CC(=CC=C1C)C)C(CCCCCCC)=O
MCULE-9366664011 0.64 C1(=CC(=CC=C1C)C)C(CCCCCCCCC)=O
MCULE-4304745400 0.64 C1(C(C)=C(C)C=C(C)C=1C)C(=O)CC(C)CC(C)(C)C
MCULE-1056639487 0.64 C(=O)(CC(C)CC(C)(C)C)C1=CC(=CC=C1C)C
MCULE-8862370468 0.64 C12C=C(O)C=CC=1C1CCC3(C)CCCC3C1CC2
MCULE-9084658203 0.64 C1(=CC(=CC=C1C)C)C(CCCCCCCCCCCCC)=O
MCULE-5284096070 0.64 C1(C=CC=C(C)C=1C)C(CCC1CCCC1)=O
MCULE-8517050516 0.64 C1(C(C)=C(C)C=C(C)C=1C)C(C(CCCC)CC)=O
MCULE-7395794338 0.64 C1(C(C2CCCC2)=O)=CC=CC(C)=C1C
MCULE-3217893922 0.64 C1(=CC(=CC=C1C)C)C(CCCCCC)=O
MCULE-1522848118 0.64 C1(=CC(=CC=C1C)C)C(C(CCCC)CC)=O
MCULE-8610879244 0.64 C1(=CC(=CC=C1C)C)C(CCCCCCCCCCC)=O
MCULE-8651651606 0.64 C1(=CC(=CC=C1C)C)C(CCCCC)=O
MCULE-1703167013 0.64 C12(C)CCC3C(CCC4C=C(OCC)C=CC3=4)C1CCC2=O
MCULE-5859882149 0.64 [C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(OCC)=CC=C34)[C@]1([H])CCC2=O)[H]
MCULE-5845361930 0.64 O=C(CC1CCC2C=C(C=CC=2C1)OC)O
MCULE-5343076200 0.64 CCOCC(COC1=CC2=C(C(CCC2)=O)C=C1)O
MCULE-3603500587 0.64 O=C1CCC(CC2C=C(OC)C=CC=21)(C(O)=O)C(O)=O
MCULE-5225229116 0.64 C1(C=C(O)C=CC=1CCCCCCCCCCCCCCC)C(O)=O
MCULE-7278805336 0.64 C12C(=O)CCC=1C=CC(C)=C2O
MCULE-1854747256 0.64 C12=CC=C(C=C1C(CCC2C1C=CC=CC=1)=O)OCC
MCULE-8171244487 0.64 C1(CCO)C(C)=C2C(=O)[C@](C)(CO)CC2=C(O)C=1C
MCULE-7087845714 0.64 C1(C(CCC)=O)=CC(O)=C(C=C1O)O
MCULE-7694979526 0.64 C12=C(OC)C=CC(OC)=C1CCCC2=O
MCULE-7837994095 0.64 O=C1C2C=CC(=CC=2CCC1)OC(F)(F)F
MCULE-8158011479 0.64 C1(C(CCC)=O)C=C(C(CCC)=O)C(=C(C)C=1O)O
MCULE-3544870645 0.64 CCC1(CC2=C(C=CC=C2)C(=O)C1)CC(O)=O
MCULE-6131428480 0.64 O=C1C2C(=C(C=CC=2CC1)OC)C
MCULE-5361789675 0.64 C1(C=O)=CC2=C(CCCC2)C=C1OC
MCULE-9082512245 0.64 C1(C(CCCCC(OC)=O)=O)C=CC(=CC=1C)OC
MCULE-4092240806 0.64 C12=CC=C(C)C=C1CCCC2=O
MCULE-3218094608 0.64 C1(C(C2CCCCC2)=O)C(C)=C(C)C(=C(C)C=1C)C
MCULE-8092450122 0.64 C1(=C(C)C=C(C(C)=C1)C)C(C1CCCCC1)=O
MCULE-4643413348 0.64 O=C(C)C1=CC2CCCCC3=CC=C(CCCCC1=CC=2CC)C=C3
MCULE-1781594526 0.64 C12C=CC=CC=1C(=O)C1C3C(=O)C4C=CC=CC=4C(=O)C3C1C2=O
MCULE-2115718815 0.64 C12C(C)(C)CCC(C)(C)C1=CC(CC)=C(C(C)=O)C=2
MCULE-5143539864 0.64 C1(C=CC(=CC=1O)O)C(C1CCCCC1)=O
MCULE-2068315694 0.64 C1(C=O)=CC(CCCCCC)=C(C=C1O)O
MCULE-2100929954 0.64 C1C(C(=O)O)C(C(C2C(CC)=CC=CC=2)=O)CCC1
MCULE-3487853278 0.64 C(C)(C1C=C2CCCCC3=CC=C(C(=C3)C(C)=O)CCCCC=1C=C2)=O
MCULE-6225070901 0.64 C(=O)(C1=CC=C(OC)C(OC)=C1)C1CCCCC1C(O)=O
MCULE-4255918632 0.64 C(C)(=O)OC1C=CC2C3CCC4(C)C(CCC4C3CC(C=2C=1)=O)OC(C)=O
MCULE-7555922943 0.64 C12(C)CCC3(C([H])(CCC4=CC(O)=CC=C34)C1([H])CCC2OC(CCC1CCCC1)=O)[H]
MCULE-9412344583 0.64 C1(O)=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCC1CCCC1)CC3)CC2
MCULE-4452698024 0.64 C12C(O)=CC=C(O)C=1C(C1C(OC(C)(C)C)CC(O)CC1C2=O)=O
MCULE-6672098100 0.64 [H][C@]12[C@@]3([H])[C@](C4C=CC(O)=CC=4CC3)([H])CC[C@]1(C)[C@@H](OC(CCCCCC)=O)CC2
MCULE-3987902732 0.64 [C@@]12([H])CC[C@H](OC(=O)CCCCCC)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
MCULE-5613759979 0.64 C1=CC2[C@@]3([H])CC[C@]4(C)[C@@H](OC(=O)CCC5CCCC5)CC[C@@]4([H])[C@]3([H])CCC=2C=C1O
MCULE-2550832067 0.64 C1C=C2C(=O)C(C(=O)C(OC)=O)CCC2=CC=1OC
MCULE-6974026012 0.64 C(OCC)(=O)CC1(CC(F)(F)F)CCC2=C(C1=O)C=CC(O)=C2
MCULE-3541798731 0.64 O=C1CC2CC(C3C=CC=CC=3C2C2C(C)=CC=CC1=2)=O
MCULE-4653923563 0.64 O=C(C1C=CC(=C(C(=O)O)C=1)O)CCCCCCC
MCULE-4339174942 0.64 C1(=C(C)C=C(C(C)=C1)OC)C(=O)C1CC1
MCULE-5689087287 0.64 C1(O)C(O)=C2[C@@]3(C(O)=O)CCCC(C)(C)[C@]3([H])CCC2=CC=1C(C)C
MCULE-5475851336 0.64 O=C(O)[C@@]12C3C(=C(C(=CC=3CC[C@@]1([H])C(C)(C)CCC2)C(C)C)O)O
MCULE-2163767412 0.64 C1C(O)=C(C(=O)CCCCC(O)=O)C=C(C)C=1
MCULE-6974232851 0.64 C1(=CC=C(OC)C(C)=C1)C(C(CCC)CCC)=O
MCULE-1497460998 0.64 C1(C=C(C)C(=C(C)C=1)OC)C(C(CCC)CCC)=O
MolPort-001-834-522 0.64 COC1=CC(C)=C(CCC(=O)C2=CC(C(C)C)=C(OC)C=C2C)C=C1C(C)C
MolPort-002-484-586 0.64 OC1=CC=C(C=C1)C(=O)CCCC(=O)C1=CC=C(O)C=C1
MolPort-009-199-925 0.64 COC1=CC=C2CC(CC(O)=O)CCC2=C1
MolPort-044-898-661 0.64 O=C1CCC2(CC2)C2=C1C=CC=C2
MolPort-030-902-343 0.64 CCCCCCC(=O)C1=CC(C)=CC=C1C
MolPort-023-308-942 0.64 CCOC1=CC2=C(C=C1)C1CCC3(C)C(CCC3=O)C1CC2
MolPort-013-274-407 0.64 CCCCCC(=O)C1=C(C)C=CC(C)=C1
MolPort-035-946-520 0.64 CCOC1=CC2=C(C=C1)[C@H]1CC[C@@]3(C)[C@@H](CCC3=O)[C@@H]1CC2
MolPort-028-610-100 0.64 CC1CC(=O)C2=C(C1O)C(O)=CC1=C2C(=O)C2=CC=CC(O)=C2C1=O
MolPort-020-709-985 0.64 CCOCC(O)COC1=CC=C2C(=O)CCCC2=C1
MolPort-002-224-271 0.64 CCOC1=CC2=C(C=C1)C(CCC2=O)C1=CC=CC=C1
MolPort-035-706-175 0.64 CC1=C(CCO)C(C)=C(O)C2=C1C(=O)[C@](C)(CO)C2
MolPort-002-846-531 0.64 CCCC(=O)C1=CC(C(=O)CCC)=C(O)C(C)=C1O
MolPort-029-879-875 0.64 OC1=C(C=O)C=C2CCCC2=C1
MolPort-035-749-150 0.64 CCC1(CC(O)=O)CC(=O)C2=C(C1)C=CC=C2
MolPort-039-242-333 0.64 OC1=CC2=C(C=C1)C(=O)CC2=O
MolPort-046-590-765 0.64 OC(=O)CC1CCCC2=CC=CC=C2C1=O
MolPort-001-572-857 0.64 CCCC(=O)C1=C(O)C=C(O)C(O)=C1
MolPort-003-937-075 0.64 COC1=CC=C(OC)C2=C1CCCC2=O
MolPort-046-690-736 0.64 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC(=O)[C@@]2(O)C#C
MolPort-002-019-747 0.64 COC1=C(C=O)C=C2CCCCC2=C1
MolPort-039-137-039 0.64 COC1=C(C)C2=C(CCC2=O)C=C1
MolPort-000-004-561 0.64 CC1=CC=C2C(=O)CCCC2=C1
MolPort-011-182-337 0.63 CCCCCC(=O)C1=CC=C(OC)C(OC)=C1
MolPort-002-023-960 0.63 COC1=CC(C)=C(C=C1)C(=O)CCC(O)=O
MolPort-002-718-987 0.63 CCCCCCCCCC(=O)C1=CC(OC)=C(OC)C=C1
MolPort-013-885-238 0.63 CCCCCCC(=O)C1=CC=C(OC)C(OC)=C1
MolPort-024-170-040 0.63 CC(C)C(=O)C1=CC=C(O)C(=C1)C(C)C
MolPort-001-793-643 0.63 CC1CCC2=C(C=CC=C2)C1=O
MolPort-001-811-930 0.63 CC(C)C1CCC2=C(C=CC=C2)C1=O
MolPort-001-785-982 0.63 CC1CC(=O)C2=C(C1)C=CC=C2
MolPort-023-313-292 0.63 CC1(C)CCC2=C(C=CC=C2)C1=O
MolPort-002-111-363 0.63 CCC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
MolPort-039-033-002 0.63 COC1=C(C)C2=C(C=C1C)C(=O)CC2
MolPort-027-720-858 0.63 C[C@]12CC[C@](C)(C[C@H]1[C@]1(C)CC[C@@]3(C)C4=C(C(=O)C=C3[C@@]1(C)CC2)C(C=O)=C(O)C(O)=C4)C(O)=O
MolPort-003-802-595 0.63 CCCCCCCCCC(=O)C1=C(O)C=C(O)C=C1
MolPort-001-741-451 0.63 OC1=CC(O)=C(C(=O)CCCCCCCCC2=CC=CC=C2)C(O)=C1
MolPort-000-761-255 0.63 CC(C)(C)C1=CC(CC2(CC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)CC(C)(C)CC2=O)=CC(=C1O)C(C)(C)C
MolPort-002-133-778 0.63 CCCCCC(=O)C1=C(O)C=C(O)C=C1
MolPort-039-137-048 0.63 COC1=CC2=C(CCCC2=O)C=C1C#N
MolPort-003-802-596 0.63 CCCCCCC(=O)C1=C(O)C=C(O)C=C1
MolPort-002-510-737 0.63 CCCCC(=O)OC1CCC2C3CCC4=C(C=CC(O)=C4)C3CC[C@]12C
MolPort-003-666-183 0.63 CCCCC(=O)O[C@H]1CCC2C3CCC4=C(C=CC(O)=C4)C3CC[C@]12C
MolPort-046-689-727 0.63 [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
MolPort-002-507-065 0.63 CCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
MolPort-000-839-939 0.63 CCCCC(=O)OC1CCC2C3CCC4=C(C=CC(O)=C4)C3CCC12C
MolPort-001-790-911 0.63 COC1=CC2=C(C=C1)C(=O)CC2CC(O)=O
MolPort-001-741-364 0.63 OC1=CC=C(CCCCC(=O)CCC2=CC=C(O)C(O)=C2)C=C1O
MolPort-006-758-000 0.63 COC(=O)C1=C2CCCCC2=CC=C1O
MolPort-006-668-505 0.63 OC1=CC=C(CCCCC(=O)CCC2=CC=C(O)C(O)=C2)C=C1
MCULE-2220194379 0.63 C1(=CC=C(OC)C(OC)=C1)C(C(CCCC)CC)=O
MCULE-6136396768 0.63 C1(C=CC(=C(OC)C=1)OC)C(CCCCC(=O)C1C=CC(=C(OC)C=1)OC)=O
MCULE-4693891477 0.63 C1(C=CC(=C(OC)C=1)OC)C(CCCCCCCCC)=O
MCULE-1392225957 0.63 C1C(=C(C(CC(C)(C(=O)O)C)=O)C=CC=1OC)C
MCULE-9689067318 0.63 C(=O)(CC(C)CC(C)(C)C)C1=CC=C(OC)C(OC)=C1
MCULE-7791198342 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCCCCCCCCCC)=O
MCULE-1900005462 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCC)=O
MCULE-5819830464 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCCCCC)=O
MCULE-2727015580 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCCC)=O
MCULE-5177276343 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCCCC)=O
MCULE-6686202204 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCCCCCCCCCC)=O
MCULE-6570893881 0.63 C1(=CC=C(C=C1C)OC)C(CCC(O)=O)=O
MCULE-7367223536 0.63 O=C1C(CC)CCC2C=CC=CC=21
MCULE-8967319478 0.63 O=C1C(C(C)C)CCC2C=CC=CC=21
MCULE-3944525970 0.63 C1(C(C)(C)C)C=C(C(CC)=O)C=C(C(C)(C)C)C=1O
MCULE-3363788850 0.63 C1(C=CC=CC=1C(C)C)C(C1CCCCC1)=O
MCULE-1312015218 0.63 C(C1CCCCC1)(=O)C1C=CC=C(C(C)C)C=1
MCULE-9801434377 0.63 C1(C=CC=C(C)C=1C)C(C(CCC)CCC)=O
MCULE-5634799677 0.63 C(C1CCCCC1)(=O)C1C=CC=C(C(C)(C)C)C=1
MCULE-2306893485 0.63 CC1C(=O)C2=C(C=CC=C2)CC1
MCULE-8957229811 0.63 CC1(C(=O)C2=C(C=CC=C2)CC1)C
MCULE-5663858314 0.63 CC(C(C1=CC(C(C)C)=C(O)C=C1)=O)C
MCULE-9664298909 0.63 C(C1CCCCC1)(=O)C1=CC=CC=C1CC
MCULE-2604461231 0.63 C(C1CCCCC1)(=O)C1=CC=CC(CC)=C1
MCULE-7033803794 0.63 C1(C=CC(=CC=1C)OC)C(C1CCC1)=O
MCULE-6450529639 0.63 C1(=C(C=C2C(=O)CCC2=C1C)C)OC
MCULE-3851740219 0.63 C1(O)=CC2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]4(C)C3=CC(=O)C=2C(C=O)=C1O
MCULE-3748073669 0.63 C[C@@]12CC[C@]3(C)C4=CC(=O)C5=C(C=O)C(O)=C(O)C=C5[C@]4(C)CC[C@@]3(C)[C@]1([H])C[C@@](C(O)=O)(C)CC2
MCULE-5510283478 0.63 C1(C(CCCCC(=O)C2=CC=C(O)C=C2O)=O)=CC=C(O)C=C1O
MCULE-2504320544 0.63 C1(C(CCCCCC)=O)=CC=C(C=C1O)O
MCULE-4858914477 0.63 C1C(O)=C(C(=O)CCCCCCCCCCCCC)C=CC=1O
MCULE-3808312487 0.63 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)O
MCULE-9941945362 0.63 C1C(C(=O)O)C(C(C2C(C)=C(C)C=CC=2)=O)CCC1
MCULE-1281773115 0.63 C1=C(O)C(C(=O)CCCCCCCCC)=CC=C1O
MCULE-1146348850 0.63 C1(C(CCCCCCCC)=O)=CC=C(C=C1O)O
MCULE-3482902278 0.63 N#CC1=C(C=C2C(=O)CCCC2=C1)OC
MCULE-1085055965 0.63 C1=CC=CC(=C1)CCCCCCCCC(=O)C1C(O)=CC(O)=CC=1O
MCULE-4914355742 0.63 O=C1C2C=C(OC)C(O)=CC=2CCCC1=C
MCULE-7251354219 0.63 C1(C(CCCCC)=O)=CC=C(C=C1O)O
MCULE-7279068618 0.63 C1(CC2=CC(C(C)(C)C)=C(C(C(C)(C)C)=C2)O)(CC2C=C(C(C)(C)C)C(=C(C(C)(C)C)C=2)O)C(=O)CC(CC1=O)(C)C
MCULE-4732647913 0.63 C1C(O)=C(C(=O)CCCCCCC)C=CC=1O
MCULE-9395580307 0.63 C1=C(OC)C=CC(=C1C)C(CCCC(=O)O)=O
MCULE-9989906502 0.63 C1C(=C(C(CC(C)CC(=O)O)=O)C=CC=1OC)C
MCULE-6732064308 0.63 [C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(O)=CC=C34)[C@]1([H])CC[C@@H]2OC(CCCC)=O)[H]
MCULE-9592219559 0.63 C=C.C12(C)CCC3C(CCC4C=C(OCC)C=CC3=4)C1CCC2=O
MCULE-2633245326 0.63 C12(C)CCC3C(CCC4=CC(O)=CC=C34)C1CCC2OC(CCCC)=O
MCULE-8517962855 0.63 CCCCC(=O)O[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])C2C=CC(=CC=2CC3)O)[H])([H])CC1
MCULE-2841840979 0.63 C1C(=C(C(CC(C)(C(=O)O)C)=O)C=C(OC)C=1)C
MCULE-1599458113 0.63 C1(=C(O)C=CC2CCCCC1=2)C(OC)=O
MCULE-5655285318 0.63 C12C=C(OC)C=CC=1C(CC2CC(O)=O)=O
MCULE-5457510724 0.63 CC1C=C(C(C2C3(CC3)C2)=O)C(C)=CC=1
MCULE-9384892339 0.63 C1=C(C=CC(CCCCC(=O)CCC2C=C(O)C(O)=CC=2)=C1)O
MCULE-3014335052 0.63 C1(=CC(=CC=C1C)C)C(CCC1CCCC1)=O
MCULE-7414244637 0.63 C1(C(CCC2CCCC2)=O)C(C)=C(C)C=C(C)C=1C
MCULE-2798680238 0.63 C1(C(C)=C(C)C=C(C)C=1C)C(C1CCCC1)=O
MCULE-8332585172 0.63 C1(C(C2CCCC2)=O)=CC(C)=CC=C1C
MCULE-8444282633 0.63 C1(O)=C(C=CC(=C1)CCCCC(=O)CCC1C=C(O)C(O)=CC=1)O
MCULE-5467366127 0.63 C1(C(C(=O)O)=C(O)C=CC=1)CCCCCCCCCCCCC
MCULE-8401158117 0.63 COC1C(C)=C(C(C2CCC2)=O)C=CC=1
MCULE-1466980797 0.63 C1(C(C(=O)O)=C(O)C=CC=1)CCCCCCCCCCCCCCC
MCULE-8912495328 0.63 O=C1C2C=C(C=CC=2CCC1)OC(F)F
MCULE-3655762824 0.63 C1(C(CCCC(OC)=O)=O)C(C)=CC(=C(C)C=1)OC
MCULE-4312262377 0.63 C12C(OC)=C(OC)C=CC=1C(C(C(C1=CC=CC=C1)=O)C2=O)CC(C1C=CC=CC=1)=O
MCULE-9512491652 0.63 C1(C(CCCC)=O)C=C(C)C(=C(C)C=1)OC
MCULE-4550143957 0.63 C1(C=C(C)C(=C(C)C=1)OC)C(C(C)CCC)=O
MCULE-4318573534 0.63 C1(C)C(C(CC)=O)=C(C)C=C(C)C=1C1CC(=O)CC(=O)C1
MCULE-9962801548 0.63 C1(=CC=C(OC)C(C)=C1)C(C(C)CCC)=O
MCULE-5428433252 0.63 C1(=CC=C(OC)C(C)=C1)C(CCCC)=O
MCULE-6402058390 0.63 C1(=C(OC)C=CC(C(=O)CCCCCC(=O)O)=C1)OC
MCULE-3939751779 0.63 C1C(=C(C(CC(C)CC(=O)O)=O)C=C(OC)C=1)C
MCULE-5470202760 0.63 C1(=C(OC)C=CC(C(=O)CCCCCCC(=O)O)=C1)OC
MCULE-3748004782 0.63 C1(C(CCCCCCCCC)=O)=CC(CCCCCC)=C(C=C1O)OC
MCULE-6413799622 0.63 O=C1C2(C)CC2(C)C(C2C=CC=CC=21)=O
MCULE-3458781824 0.63 C1(C2CCCCC2)=C(O)C=C(C(C2CCCCC2)=C1)C
MCULE-7848250635 0.63 C12C(C)(C)CC(C)(C)C=1C=C(C(O)=C2C(C)C)C(C)C
MCULE-4601703150 0.63 C1CC(C(=O)C2C(C)=C(C)C=CC=2)CCC1C(=O)O
MCULE-5107783779 0.63 C1(C(C)C)=C(OC)C=CC(C(CCC(O)=O)=O)=C1
MCULE-5872671103 0.63 C12=C(C=CC=C1CCC(C2)C(O)=O)O
MCULE-4468630789 0.63 C1(C(CCC2C=CC=CC=2)=O)C(C)=CC(=C(C)C=1)OC
MCULE-8638087020 0.63 C1(=CC=C(OC)C(OC)=C1)C(C1CCCC1)=O
MCULE-3029989098 0.63 C1(=CC=C(OC)C(OC)=C1)C(CCC1CCCC1)=O
MCULE-9654812546 0.63 C1(=O)C2=C(C=C(OCC3=CC=CC=C3)C=C2)CCC1
MCULE-4787929533 0.63 C1C=C2OCCC(=O)C2=C2CCCCC2=1
MolPort-006-822-507 0.63 CCCCCCCCCCCCCCCC1=C(C(O)=O)C(O)=CC=C1
MolPort-020-005-780 0.63 CCCCCCCCCCCCCC1=CC=CC(O)=C1C(O)=O
MolPort-001-900-961 0.63 CCC(=O)C1=C(C)C=C(C)C(C2CC(=O)CC(=O)C2)=C1C
MolPort-039-052-661 0.63 COC1=CC(O)=C2C(CCC22CCC(=O)CC2)=C1
MolPort-011-720-556 0.63 O=C1CCCC2=CC(OCC3=CC=CC=C3)=CC=C12
MolPort-008-606-936 0.63 COC1=CC=C(C=C1C(C)C)C(=O)CCC(O)=O
MolPort-023-313-434 0.63 OC(=O)CCCCC1=CC(O)=C(O)C=C1
MolPort-003-724-430 0.63 CC1=C(C=C(C2CCCCC2)C(O)=C1)C1CCCCC1
MolPort-001-812-200 0.63 CC1(C)CCC2=C(C=CC=C2)C(=O)C1
MolPort-042-681-231 0.63 O=C1C2CC(C2)C2=CC=CC=C12
MolPort-039-338-956 0.63 CC1=C2C(=O)C=C3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@@](C)(CC[C@]5(C)CC[C@]34C)C(O)=O)C2=CC(O)=C1O
MolPort-001-793-364 0.63 O=C1CCCCC2=C1C=CC=C2
MolPort-030-084-234 0.62 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@@H]2O
MolPort-046-196-751 0.62 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@H]2O
MolPort-046-761-812 0.62 C[C@]12CC[C@H]3C(CCC4=CC(O)=CC=C34)[C@@H]1C[C@@H](O)C2O
MolPort-002-864-389 0.62 OCC1(CO)CCC2=C(C=CC=C2)C1=O
MolPort-002-506-898 0.62 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)C2O
MolPort-006-394-001 0.62 C[C@]12CCC3[C@@H](CCC4=CC(O)=CC=C34)C1CC(O)[C@@H]2O
MolPort-046-764-605 0.62 [2H]C1([2H])[C@H]2[C@@H]3C[C@@H](O)[C@@H](O)[C@@]3(C)CC[C@]2([2H])C2=CC=C(O)C=C2C1([2H])[2H]
MolPort-006-069-173 0.62 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@H](O)[C@@H]2O
MolPort-046-689-730 0.62 [2H]C1=CC2=C(CC[C@H]3[C@@H]4C[C@@H](O)[C@]([2H])(O)[C@@]4(C)CC[C@H]23)C([2H])=C1O
MolPort-028-949-970 0.62 OC(=O)C1=C(O)C2=C(CCCC2)C=C1
MolPort-003-892-015 0.62 CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CC(O)C2O
MolPort-001-739-701 0.62 CC1(O)CC(=O)C2=C3C(=O)C4=CC=CC(O)=C4C(=O)C3=CC=C2C1
MolPort-006-394-002 0.62 [2H]C1=C(O)C([2H])=C2CC[C@H]3C4CC(O)[C@]([2H])(O)[C@@]4(C)CCC3C2=C1
MolPort-044-561-949 0.62 [2H]C1=C(O)C([2H])=C2CC[C@H]3[C@@H]4C[C@@H](O)[C@H](O)[C@@]4(C)CC[C@@H]3C2=C1
MolPort-003-711-142 0.62 COC1=CC=CC(=C1)C(C1C(=O)C2=CC=CC=C2C1=O)C1C(=O)C2=CC=CC=C2C1=O
MolPort-002-512-277 0.62 C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@@H]2O
MolPort-039-338-056 0.62 CCCCCCCC(=O)C1=C(CC(=O)OCC)C=C(O)C=C1O
MolPort-008-155-196 0.62 CCOC(=O)C(=O)C1CCC2=CC(OC)=CC=C2C1=O
MolPort-035-765-160 0.62 OC(=O)C1=CC2=C(C=C1)C(=O)CCCC2
MolPort-001-948-949 0.62 CCC1=CC2=C(C=C1C(C)=O)C(C)(C)CCC2(C)C
MolPort-030-902-470 0.62 CCCCCCC(=O)C1=CC(C)=C(C)C=C1C
MolPort-030-902-469 0.62 CCCCCC(=O)C1=CC(C)=C(C)C=C1C
MolPort-000-707-361 0.62 CC1CC(C)(C)C2=C(C=C(C)C(=C2)C(C)=O)C1(C)C
MolPort-008-605-389 0.62 CCCCC(=O)C1=CC2=C(CCCC2)C=C1
MolPort-002-916-093 0.62 CC1CCC2=C3C=CC4=C(CCC(C)C4=O)C3=CC=C2C1=O
MolPort-019-678-497 0.62 CCOC1=CC=C(CCC(=O)OC2=CC=C3C(=O)CCCC3=C2)C=C1
MolPort-038-359-197 0.62 CC(=O)C1=CC=C2CCCC2=C1O
MolPort-046-761-772 0.62 C[C@]12CCC(=O)[C@@H](CCC3=CC(O)=CC=C3O)[C@@H]1CC[C@@H]2O
MCULE-2035383302 0.62 C1(C(CCC(OC)=O)=O)C(C)=CC(=C(C)C=1)OC
MCULE-8354770318 0.62 O=C1C2=C(C=CC=C2)CCCC1
MCULE-6391534364 0.62 C(=O)(CC1(CCCCC1)CC(O)=O)C1=CC=C(OC)C(OC)=C1
MCULE-3354474079 0.62 CC1(CC(=O)C2=C(C=CC=C2)CC1)C
MCULE-9428657357 0.62 C1(=CC(=CC=C1C)C)C(C(CCC)CCC)=O
MCULE-8899566705 0.62 C1(C(CCCCBr)=O)C(C)=CC(=C(C)C=1)OC
MCULE-7403590701 0.62 C1(C(CCCCCl)=O)C(C)=CC(=C(C)C=1)OC
MCULE-7335047873 0.62 C1C=CC2C(=O)CC(C)C(=O)C=2C=1
MCULE-4368087118 0.62 C1(C(C)=C(C)C=C(C)C=1C)C(C(CCC)CCC)=O
MCULE-8277456271 0.62 C1(O)=CC2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]4(C)C3=CC(=O)C=2C(C)=C1O
MCULE-7703383876 0.62 O=C1C(C)(C)CCC(C)(C)C2=C1C=CC=C2
MCULE-4267989610 0.62 C12=CC=C(OC)C=C1CCCC(Br)C2=O
MCULE-4074142300 0.62 OC(C1C=CC2CCCCC=2C=1O)=O
MCULE-8808440246 0.62 C1(C(C2=CC=CC(OC)=C2)C2C(=O)C3=C(C=CC=C3)C2=O)C(=O)C2=C(C=CC=C2)C1=O
MCULE-9835365387 0.62 C1(C(CCC1)C(=O)O)C(C1C(CC)=CC=CC=1)=O
MCULE-7787158596 0.62 C1(C(C2C(C(C)C)=CC=CC=2)=O)C(CCC1)C(O)=O
MCULE-4009524570 0.62 [C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(O)=CC=C34)[C@]1([H])C[C@@H](O)[C@@H]2O)[H]
MCULE-5233001157 0.62 C(=O)(CC1(CCCCC1)CC(O)=O)C1=CC=CC=C1CC
MCULE-3406586138 0.62 C12(C)CCC3C(CCC4C=C(O)C=CC3=4)C1CC(O)C2O
MCULE-5956361921 0.62 C1(=O)C2C=CC=CC=2CCC1(CO)CO
MCULE-1153861848 0.62 C1(CC(C(=O)C2C(CC)=CC=CC=2)CCC1)C(O)=O
MCULE-5497037217 0.62 C1C(C(=O)O)C(C(C2C(C)=CC=C(C)C=2)=O)CCC1
MCULE-7584379663 0.62 C1C=C2[C@@]3([H])CC[C@]4(C)[C@@H](O)[C@H](O)C[C@@]4([H])[C@]3([H])CCC2=CC=1O
MCULE-6282924936 0.62 O=C(CC1C(C(=O)CCCCCCC)=C(O)C=C(O)C=1)OCC
MCULE-6051033316 0.62 C1(CCC2=CC(OC)=CC=C2C1=O)C(=O)C(OCC)=O
MCULE-4452919964 0.62 C1(=O)C2=C(C(Br)=CC=C2O)CCC1
MCULE-6892049118 0.62 C1(=CC=C(OC)C(OC)=C1)C(C(CCC)CCC)=O
MCULE-4053632512 0.62 C1(=C(OC)C(=CC(C(=O)CCCCCC(=O)O)=C1)C)C
MCULE-5975540284 0.62 C1(=O)C2=C(C=C(I)C=C2C)CCC1
MCULE-9868206145 0.62 C1(=C(OC)C(=CC(C(=O)CCCCC(=O)O)=C1)C)C
MCULE-8544205686 0.62 O=C(C(C(C(=O)C1C=C(OC)C(OC)=CC=1)C)C)C1C=C(OC)C(OC)=CC=1
MCULE-5193874465 0.62 C[C@H]([C@H](C)C(=O)C1C=C(OC)C(OC)=CC=1)C(=O)C1C=C(OC)C(OC)=CC=1
MCULE-9045472057 0.62 OC(C1=CC2=C(C(CCCC2)=O)C=C1)=O
MCULE-9012560365 0.62 C1(=C(OC)C(=CC(C(=O)CCCCCCC(=O)O)=C1)C)C
MCULE-6161150896 0.62 C1(=C(C)C=C(C)C(C)=C1)C(=O)CC(C)CC(C)(C)C
MCULE-7420965604 0.62 C1(C(CCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-3537008522 0.62 C1(C(C(CCCC)CC)=O)C(C)=C(C)C(=C(C)C=1C)C
MCULE-8340248492 0.62 C1(C(CCCCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-1728690460 0.62 C1(=C(C)C=C(C)C(C)=C1)C(C(CCCC)CC)=O
MCULE-5128561438 0.62 C12C=C(C)C(=CC=1C(CC(C)C2(C)C)(C)C)C(C)=O
MCULE-4939144640 0.62 C1(C(CCCCCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-2985103721 0.62 CCCCC(=O)C1C=C2C(CCCC2)=CC=1
MCULE-9487281718 0.62 C1(C(CCCCCCCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-1760283025 0.62 C1(C(CCCCCCCCCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-9128258306 0.62 C(C1=C(CC)C=C2C(C)(C)CCC(C)(C)C2=C1)=O
MCULE-1391102169 0.62 C1(C(CCCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-2636452625 0.62 C1(C(CCCCCC)=O)=C(C)C=C(C)C(C)=C1
MCULE-8642810872 0.62 C1(C(C)C)C=C(C(C)C)C=C(C(C)C)C=1C(CCCC)=O
MCULE-4105789108 0.62 C12=CC=C3C(=O)C(CCC3=C1C=CC1C(=O)C(CCC2=1)C)C
MCULE-9013859439 0.62 C1(C(=O)CC(C)CC(C)(C)C)C(C)=C(C)C(=C(C)C=1C)C
MCULE-8798434771 0.62 CCOC1=CC=C(CCC(OC2=CC3=C(C(CCC3)=O)C=C2)=O)C=C1
MCULE-5756591772 0.62 C1(C2CC3CC1CC(C3)C2)C(=O)C1C=CC=C(OC)C=1
MCULE-8669679336 0.62 C1(=CC(C)=C(C(C)=C1)OC)C(C1CCC1)=O
MCULE-2660548512 0.62 C1(C=CC(=C(C)C=1)OC)C(C1CCC1)=O
MCULE-5851402328 0.62 C1(C(C2CCCCC2)=O)=CC=CC(OC)=C1
MCULE-7094436706 0.62 C(=O)(CC(C)CC(C)(C)C)C1=CC=CC(CC)=C1
MCULE-6152302567 0.62 C1(C=CC=C(C)C=1C)C(C(C)CCC)=O
MCULE-6546499073 0.62 C(C(CCCC)CC)(=O)C1=CC=CC(CC)=C1
MCULE-2148891680 0.62 C12C=CC=CC=1C(C)CCC2=O
MCULE-1230172087 0.62 C1(C=CC=C(C(C)C)C=1)C(C(CCCC)CC)=O
MCULE-6545098104 0.62 C1(=CC=CC=C1CC)C(CCCCC)=O
MCULE-5478115725 0.62 C1(=CC=CC=C1CC)C(CCCCCCCCCCC)=O
MCULE-1705264508 0.62 C1(C=CC=C(C)C=1C)C(CCCC)=O
MCULE-6400359041 0.62 C1(C(C2CCCCC2)=O)=C(C)C=CC=C1C
MCULE-1102579303 0.62 C(CCCC)(=O)C1=CC=C(C=C1)O
MCULE-6004377662 0.62 C1(=CC=CC=C1CC)C(CCCCCCCCC)=O
MCULE-4793039782 0.62 C1(=CC=CC=C1CC)C(CCCCCC)=O
MCULE-9235377668 0.62 C(C(CCCC)CC)(=O)C1=CC=CC=C1CC
MCULE-4877665443 0.62 C(=O)(CC(C)CC(C)(C)C)C1=CC=CC=C1CC
MCULE-4534985459 0.62 C1(=CC=CC=C1CC)C(CCCCCCCC)=O
MCULE-7611202749 0.62 CC1(C2=C(C=CC=C2)C(=O)CC1)C
MCULE-4662583492 0.62 C(=O)(CC(C)CC(C)(C)C)C1C=CC=C(C(C)(C)C)C=1
MCULE-9474547825 0.62 C(=O)(CC(C)CC(C)(C)C)C1C=CC=C(C(C)C)C=1
MCULE-8394622903 0.62 C1(=CC=CC=C1CC)C(CCCCCCC)=O
MCULE-9155168159 0.62 C(=O)(CC(C)CC(C)(C)C)C1C=CC=CC=1C(C)C
MCULE-3095985289 0.62 C1(C=CC=CC=1C(C)C)C(C(CCCC)CC)=O
MCULE-3997524295 0.62 C1(C=CC=C(C(C)(C)C)C=1)C(C(CCCC)CC)=O
MCULE-1242344114 0.62 C1(=CC=CC=C1CC)C(CCCCCCCCCCCCC)=O
MCULE-4115730517 0.62 COC1C(=O)C2=C(C=C(C(=C2O)OC)OC)CCC1
MCULE-4651426536 0.62 C(=O)(C1CCCCC1C(OC)=O)C1C=C(C)C=CC=1O
MCULE-7903465500 0.62 C1(=CC=C(C(OC)=C1)O)C(CCC(O)=O)=O
MCULE-7121288811 0.62 C1C(C(=O)O)C(C(C2C=C(OC)C=CC=2)=O)CCC1
MCULE-8582260501 0.62 C12(C)CCC3C(CCC4=CC(=C(C(C)=O)C=C34)OC)C1CCC2OC(C)=O
MCULE-3745648974 0.62 C12(C)C3C=CC4C(C=3CCC1(C)C(CC2)=O)=CC=C(O)C=4
MCULE-2339215372 0.62 C1C(C(=O)O)C(C(C2C(C)=CC=CC=2C)=O)CCC1
MCULE-1317758392 0.62 C1CC(C(=O)C2C(C)=CC=C(C)C=2)CCC1C(=O)O
MCULE-4855373269 0.62 C(O)(=O)CC1CC2=C(C1)C=CC(O)=C2
MCULE-8443509839 0.62 [C@@]12([H])CCC(=O)[C@@]1(C)CCC1=C3C=CC(O)=CC3=CC=C21
MCULE-5332029701 0.62 C12CCC(=O)[C@@]1(C)CCC1=C3C=CC(O)=CC3=CC=C21
MCULE-7960858745 0.62 C1(C=CC2=C(CCO2)C=1)C(C1CCCCC1)=O
MCULE-8892951343 0.62 [C@@]1([H])(CC[C@](O)(C)[C@]2([H])C[C@H](C(O)(C)C)CC[C@@]12C)[C@H](CC(C)C)C1=C(C(=C(O)C(C=O)=C1O)C=O)O
MCULE-6146217320 0.62 C1(OC)=CC=CC(CCC(=O)C2C(C)=C(C)C=CC=2)=C1
MCULE-8488688043 0.62 [C@@]1([H])(CC[C@](O)(C)[C@]2([H])C[C@H](C(O)(C)C)CC[C@@]12C)[C@@H](CC(C)C)C1=C(C(=C(O)C(C=O)=C1O)C=O)O
MCULE-7075872269 0.62 C1(=O)C2=C(C(Br)=CC=C2O)CC(C(C)=O)C1
MCULE-1634437857 0.62 CC(=O)C1C2CCCC=2C=CC=1
MCULE-9830249271 0.62 C1(C(C)(C)C)C=C(C(CCCCN2CCCCC2)=O)C=C(C(C)(C)C)C=1O
MCULE-8310784762 0.62 C1(C(C2=CC=CC=C2)CC(=O)C2C=CC=C(C)C=2)C(=O)C2=C(C=CC=C2)C1=O
MCULE-6448230950 0.62 C1(O)C=C(CCC(=O)C[C@@H](O)CCC2C=C(O)C(O)=CC=2)C=CC=1O
MCULE-9955490975 0.62 OC(CC(=O)CCC1C=CC(O)=CC=1)CCC1C=CC(O)=C(O)C=1
MCULE-2262370884 0.62 C1(=O)C2=CC(C)=CC=C2CC1C(CCC1C=CC(=CC=1)C)=O
MCULE-1811772745 0.62 C1C(O)=C(CCCCCCC)C(C=O)=C(O)C=1C/C=C(\C)/C
MCULE-2416250816 0.62 C1(=CC(C)=CC(C)=C1O)C(CCC(O)=O)=O
MCULE-2766228911 0.62 C1(=CC(=CC=C1O)C)C(=O)CC(=O)CC
MCULE-7993284271 0.62 OC1=C2C(C(CC2)=O)=CC=C1
MCULE-3125812363 0.62 C1(C=C(C)C=CC=1O)C(CCC(O)=O)=O
MolPort-030-902-375 0.62 CCCCCCC(=O)C1=CC=CC=C1CC
MolPort-025-484-091 0.62 CCCCC(=O)C1=CC=CC(C)=C1C
MolPort-030-902-374 0.62 CCCCCC(=O)C1=CC=CC=C1CC
MolPort-001-793-306 0.62 CC1CCC(=O)C2=C1C=CC=C2
MolPort-001-791-394 0.62 CCCCC(=O)C1=CC=C(O)C=C1
MolPort-001-816-199 0.62 CC1(C)CCC(=O)C2=C1C=CC=C2
MolPort-035-941-699 0.62 CCCCCC1=C(C(O)=O)C(O)=CC(O)=C1
MolPort-001-916-958 0.62 COC1CCCC2=CC(OC)=C(OC)C(O)=C2C1=O
MolPort-008-821-502 0.62 COC1=C(O)C=CC(=C1)C(=O)CCC(O)=O
MolPort-019-936-888 0.62 CC(C)C1=CC2=C(C=C1O)C1(C)CCCC(C)(C)C1C(O)C2
MolPort-006-122-465 0.62 CCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12C
MolPort-023-213-437 0.62 COC1=CC(=CC=C1)C(=O)[C@H]1CCCC[C@H]1C(O)=O
MolPort-002-508-865 0.62 COC1=C(C=C2C3CC[C@]4(C)[C@@H](CCC4[C@@H]3CCC2=C1)OC(C)=O)C(C)=O
MolPort-002-320-681 0.62 COC1=C(C=C2C3CCC4(C)C(CCC4C3CCC2=C1)OC(C)=O)C(C)=O
MolPort-046-693-665 0.62 C[C@]12CCC3=C(C=CC4=CC(O)=CC=C34)C1CCC2=O
MolPort-003-929-224 0.62 C[C@]12CCC3=C4C=CC(O)=CC4=CC=C3[C@@H]1CCC2=O
MolPort-002-477-352 0.62 O=C1CCCC1C(C1CCC2=C(C=CC=C2)C1=O)C1=CC=CC=C1
MolPort-035-706-261 0.62 CC(C)C[C@@H]([C@@H]1CC[C@@](C)(O)[C@@H]2C[C@@H](CC[C@@]12C)C(C)(C)O)C1=C(O)C(C=O)=C(O)C(C=O)=C1O
MolPort-035-706-260 0.62 CC(C)C[C@H]([C@@H]1CC[C@@](C)(O)[C@@H]2C[C@@H](CC[C@@]12C)C(C)(C)O)C1=C(O)C(C=O)=C(O)C(C=O)=C1O
MolPort-046-419-215 0.62 CC(=O)C1CC(=O)C2=C(O)C=CC(Br)=C2C1
MolPort-039-338-794 0.62 COC1=C(O)C2=C(CC[C@H]3C(C)(C)CCC[C@]23C)C=C1C(C)C
MolPort-004-772-506 0.62 CC(=O)C1=C2CCCC2=CC=C1
MolPort-002-471-366 0.62 OC1=CC=CC2=C1CCC2=O
MolPort-001-822-659 0.62 CC1=CC(C(=O)CCC(O)=O)=C(O)C=C1
MolPort-039-143-701 0.62 CC1=CC=C(CCC(=O)C2CC3=C(C=C(C)C=C3)C2=O)C=C1
MolPort-001-741-363 0.62 OC(CCC1=CC=C(O)C(O)=C1)CC(=O)CCC1=CC=C(O)C=C1
MolPort-021-804-647 0.62 CCCCCCCC1=C(O)C=C(CC=C(C)C)C(O)=C1C=O
MolPort-035-706-151 0.62 O[C@@H](CCC1=CC=C(O)C(O)=C1)CC(=O)CCC1=CC=C(O)C(O)=C1
MolPort-001-915-639 0.62 CC1=CC=CC(=C1)C(=O)CC(C1C(=O)C2=CC=CC=C2C1=O)C1=CC=CC=C1
MolPort-023-213-489 0.61 COC1=CC(=CC=C1)C(=O)[C@@H]1CC[C@@H](CC1)C(O)=O
MolPort-000-005-183 0.61 OC(=O)C1=CC2=C(CCCCC2=O)C=C1
MolPort-023-213-516 0.61 COC1=CC(=CC=C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O
MolPort-023-213-622 0.61 COC1=CC=CC(=C1)C(=O)C[C@H]1CC[C@H](CC1)C(O)=O
MolPort-001-943-396 0.61 O=C1CC2(CCCCC2)C2=C1C=CC=C2
MolPort-002-800-769 0.61 OC(=O)CCC(=O)C1=CC=C(O)C=C1
MolPort-002-691-981 0.61 CC(C)(C)C1=CC(CC(C(=O)C2=CC=CC=C2)C(=O)C2=CC=CC=C2)=CC(=C1O)C(C)(C)C
MolPort-023-213-536 0.61 CC1=CC=CC(C)=C1C(=O)[C@H]1CC[C@@H](CC1)C(O)=O
MolPort-006-668-615 0.61 OC(CCC(=O)CCC1=CC=C(O)C(O)=C1)CC1=CC(O)=C(O)C=C1
MolPort-001-497-662 0.61 OC(=O)C1CCCCC1C(=O)C1=C(O)C2=CC=CC=C2C=C1
MolPort-002-151-198 0.61 CC1=CC(C(=O)CC(=O)C2=C(C)C=CC=C2)=C(O)C=C1
MolPort-001-927-757 0.61 CCCOC1=CC=C(C=C1)C(=O)CCCCC(=O)C1=CC=C(OCCC)C=C1
MolPort-001-742-313 0.61 C[C@]12CC[C@](C)(C[C@H]1[C@]1(C)CC[C@@]3(C)C4=C(C=C(O)C(O)=C4)C(=O)C=C3[C@@]1(C)CC2)C(O)=O
MolPort-008-604-685 0.61 CCCCC(=O)C1=C(C)C=CC(C)=C1
MolPort-029-006-316 0.61 OC1=CC2=C(CCCCC2)C=C1
MolPort-039-348-097 0.61 CCCCCCOC1=CC2=C(C=C1)[C@H]1CC[C@@]3(C)[C@@H](CCC3=O)[C@@H]1CC2
MolPort-046-195-532 0.61 O=C1CCC2=CC=C3CCCC3=C12
MolPort-003-738-180 0.61 COC1=CC=C(C=C1)C(=O)C1CCCCC1
MolPort-001-761-999 0.61 CCCCC1=C(O)C(=CC(C(C)=O)=C1O)C(C)=O
MCULE-6751663936 0.61 C1CC(C(=O)C2C(C)=CC=CC=2C)CCC1C(=O)O
MCULE-4239634418 0.61 C12(CCCCC1)CC(C1C=CC=CC2=1)=O
MCULE-5425938673 0.61 C(CCC(O)=O)(=O)C1=CC=C(C=C1)O
MCULE-8784072681 0.61 C(CC1=CC(C(C)(C)C)=C(C(C(C)(C)C)=C1)O)(C(C1=CC=CC=C1)=O)C(C1C=CC=CC=1)=O
MCULE-6542987958 0.61 C1(C(C2CCCC2)=O)C(C)=C(C)C(=C(C)C=1C)C
MCULE-2171235397 0.61 C1(C)C(C)=C(C)C(=C(C)C=1C(CCC1CCCC1)=O)C
MCULE-6072882257 0.61 C(CCCCC(=O)C1C=CC(=CC=1)OCCC)(=O)C1=CC=C(C=C1)OCCC
MCULE-7038757004 0.61 O=C1CC(C)C2C(O)=CC=C(O)C=21
MCULE-3086474117 0.61 C1(C=CC2C(=CC=CC=2)C=1O)C(=O)C1CCCCC1C(O)=O
MCULE-6781654416 0.61 C1(C=C(C)C=CC=1O)C(=O)CC(=O)C1=CC=CC=C1C
MCULE-9021203440 0.61 C1(C=C(C)C=CC=1O)C(CCCC(O)=O)=O
MCULE-8097976673 0.61 C1(O)C=C(CC(O)CCC(=O)CCC2C=C(O)C(O)=CC=2)C=CC=1O
MCULE-3937568795 0.61 C12C=C(OC)C(=CC=1CCC(C[NH+](C)C)C2=O)OC
MCULE-2093210183 0.61 C1(C(CCCCCBr)=O)C=CC(=CC=1C)OC
MCULE-2935974486 0.61 O=C1C2C=CC=C3CCC4C(=CC=CC=4)C(CCC1)C=23
MCULE-7024071968 0.61 C1(=C(C=C2C(C=C3[C@@](C2=C1)(C)CC[C@]1([C@]2([C@](CC[C@]31C)(C)CC[C@@](C)(C(=O)O)C2)[H])C)=O)O)O
MCULE-7236206098 0.61 C1(=CC(=CC=C1C)C)C(CCCC)=O
MCULE-8918735251 0.61 C1(=CC(=CC=C1C)C)C(C(C)CCC)=O
MCULE-8301378360 0.61 C1(C(C)=C(C)C=C(C)C=1C)C(C(C)CCC)=O
MCULE-4387580770 0.61 C1(C(CCCC)=O)C(C)=C(C)C=C(C)C=1C
MCULE-2846039940 0.61 CCC1C=C(C(C2C3(CC3)C2)=O)C=CC=1
MCULE-5108766144 0.61 C1(=CC=CC(C)=C1C)C(C1CCC1)=O
MCULE-1938615296 0.61 C(C1CCCC1)(=O)C1C=CC=C(C(C)(C)C)C=1
MCULE-9653791379 0.61 [C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(OCCCCCC)=CC=C34)[C@]1([H])CCC2=O)[H]
MCULE-4107259796 0.61 C12(C)CCC3C(CCC4C=C(OCCCCCC)C=CC3=4)C1CCC2=O
MCULE-7406635268 0.61 C1=C(C=CC=C1C(C)(C)C)C(CCC1CCCC1)=O
MCULE-2506107130 0.61 C(C1CCCC1)(=O)C1=CC=CC=C1CC
MCULE-9971941799 0.61 C(C1C=CC2C3CCCC(C=3C=CC=2C=1)=O)=O
MCULE-2940654867 0.61 C(C)(C)(C)C(OC1C=CC2C3CCC4(C)C(CCC4C3CCC=2C=1)=O)=O
MCULE-5865277013 0.61 CCC1C(C(C2C3(CC3)C2)=O)=CC=CC=1
MCULE-1157335944 0.61 C1(C=CC=CC=1C(C)C)C(C1CCCC1)=O
MCULE-4735865082 0.61 C1(C(OC)=O)=CC2CCCCC=2C(C)=C1O
MCULE-7159876773 0.61 C(C1CCCC1)(=O)C1C=CC=C(C(C)C)C=1
MCULE-2507724013 0.61 C1CC(=O)C2C3C=CC(C)=CC=3C=CC=2C1
MCULE-7422952554 0.61 C1(=CC=CC=C1CC)C(CCC1CCCC1)=O
MCULE-4163077000 0.61 C1C(=CC=CC=1C(CCC1CCCC1)=O)C(C)C
MCULE-3710703674 0.61 C1(C=CC=CC=1C(C)C)C(CCC1CCCC1)=O
MCULE-7584682799 0.61 CC1CC(C(C2=C(C)C(C)=CC=C2)=O)C1
MCULE-8512488688 0.61 C(CCC1CCCC1)(=O)C1=CC=CC(CC)=C1
MCULE-2995176862 0.61 C(C1CCCC1)(=O)C1=CC=CC(CC)=C1
MCULE-3212780077 0.61 C1(C2CCCCC2CC2=CC=CC=C12)CCC1=CC=CC(O)=C1C(=O)OC
MCULE-9703159668 0.61 C1(C(CCCCC(=O)C2=CC=C(C=C2O)C)=O)=CC=C(C=C1O)C
MCULE-4011546628 0.61 C(=O)(CC1CCCCC1)C1C=CC(OC)=CC=1
MCULE-1992870705 0.61 C1(C(CCC1)C(=O)O)C(C1C(C)=C(C)C=CC=1)=O
MCULE-4725291311 0.61 C1(C(CCCCCCCCCC)=O)=CC=C(C=C1O)C
MCULE-4047146070 0.61 C1(C(C2CCCCC2)=O)=CC=C(OC)C=C1
MCULE-5859528748 0.61 C1(C(CCCCCCCCCCC)=O)=CC=C(C=C1O)C
MCULE-4248679906 0.61 C1(C)C=C(C)C(C(=O)CCC)=C(O)C=1
MCULE-6746449344 0.61 C1(C(C)=O)C=C(C(C)=O)C(=C(CCCC)C=1O)O
MCULE-3080340759 0.61 C(=O)(CC1(CCCCC1)CC(O)=O)C1C=CC=C(C)C=1C
MCULE-5621891672 0.61 C1(CC(C(=O)C2C(C)=C(C)C=CC=2)CCC1)C(O)=O
MCULE-6689253515 0.61 C1(C(CCCCCCC(=O)C2=CC=C(C=C2O)C)=O)=CC=C(C=C1O)C
MCULE-1306869595 0.61 C1(C(CCCCCCCCCCC(=O)C2=CC=C(C=C2O)C)=O)=CC=C(C=C1O)C
MCULE-1045150648 0.61 C1CC2C3C(=O)CCC=3C=CC=2C1
MCULE-2999979510 0.61 C1(CCCCC1)(CC(=O)C1C=CC(=CC=1)OC)C(O)=O
MCULE-9175501672 0.61 C(C1CCCCC1)(=O)C1=CC=CC(OC(C)C)=C1
MCULE-9264734005 0.61 CCCCC(=O)C1C=C(OC)C(OC)=CC=1
MCULE-8086514670 0.61 C1(OC)=CC=CC(CCC(=O)C2C(C)=CC=C(C)C=2)=C1
MCULE-1748882571 0.61 C(C1CCCCC1)(=O)C1=CC=CC(OCC)=C1
MCULE-8128775754 0.61 O=CC1CCC2C=C(C=CC=2C1)OC
MCULE-2822395107 0.61 [C@@H]1(C(O)=O)CCCC[C@@H]1C(=O)C1=CC=C(OC)C=C1
MCULE-4467462439 0.61 [C@@]1([H])(CC[C@](O)(C)[C@]2([H])[C@H]3C(C)(C)[C@H]3CC[C@@]12C)[C@@H](CC(C)C)C1=C(C(=C(O)C(C=O)=C1O)C=O)O
MCULE-1912824773 0.61 CC1(C2=C(C=C(C(O)=O)C=C2)C(=O)CC1)C
MCULE-3921495297 0.61 C1C(C(=O)O)C(C(C2C=CC(OC)=CC=2)=O)CCC1
MCULE-2386652562 0.61 C1(=CC=C(OC)C(OC)=C1)C(C(C)CCC)=O
MCULE-8412266432 0.61 C1(C(CCCC(OC)=O)=O)C=CC(=CC=1C)OC
MCULE-3172890387 0.61 [Cl-].C1(C(C)(C)C)C=C(C(CCCC[NH+]2CCCCC2)=O)C=C(C(C)(C)C)C=1O
MCULE-6982536562 0.61 C1(O)=CC2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)OC)CC[C@]5(C)CC[C@]4(C)C3=CC(=O)C=2C(C=O)=C1O
MCULE-7497613548 0.61 C1(C(CCCC(OCC)=O)=O)C(C)=CC(=C(C)C=1)OC
MCULE-9955645453 0.61 C1(=CC=C2C(CCCC2)=C1)C(CCC)=O
MCULE-4610100104 0.61 C1(C(C(CCC)CCC)=O)C(C)=C(C)C(=C(C)C=1C)C
MCULE-1737289899 0.61 C1(=CC=CC=C1O)C(CCCCCCCC)=O
MCULE-2252041593 0.61 C1C=C(C(=O)CCCCC)C(O)=CC=1
MCULE-3275944451 0.61 C1(C=C(C=CC=1C(=O)CC(C)(C)C)CC(C)(C)C)CC(C)(C)C
MCULE-7263164299 0.61 C12C=C(C(C)=CC=1C(C)(C)CCC2(C)C)C(=O)C
MCULE-1420923156 0.61 C(=O)(CC(C)C)C1=CC=C2C(CCCC2)=C1
MCULE-4333826764 0.61 C1(=C(C)C=C(C)C(C)=C1)C(C(CCC)CCC)=O
MCULE-7196238993 0.61 C1C(O)=C(C(=O)CCC)C=C(C)C=1
MCULE-2757580883 0.61 C1(CC(=O)C2C=CC(=CC=2)OC)C(=O)CC(CC1=O)(C)C
MCULE-5896936944 0.61 C(C1CCCCC1)(=O)C1C=CC(=CC=1)OCC
MCULE-4233917458 0.61 C1(C=CC=C(OC)C=1)C(CCCCCCC)=O
MCULE-5768201565 0.61 C1(C=CC=C(OC)C=1)C(CCCCC)=O
MCULE-3540631562 0.61 C(=O)(C1CCCCC1C(O)=O)C1=C(C)C=C(C)C(C)=C1
MCULE-2676442078 0.61 C(=O)(CC(C)CC(C)(C)C)C1C=CC=C(OC)C=1
MCULE-5897800793 0.61 C1(C=CC=C(OC)C=1)C(CCCCCCCC)=O
MCULE-7123183634 0.61 C(C1CCCCC1)(=O)C1C=CC(=CC=1)OC1=CC=CC=C1
MCULE-4015120270 0.61 C1(C=CC=C(OC)C=1)C(CCCCCCCCC)=O
MCULE-9960042555 0.61 C(C1CCCCC1)(=O)C1C=CC(=CC=1)OC(C)(C)C
MCULE-7663508908 0.61 C1(C=CC=C(OC)C=1)C(CCCCCCCCCCC)=O
MCULE-5741753004 0.61 C1(C=CC=C(OC)C=1)C(CCCCCCCCCCCCC)=O
MCULE-4494675390 0.61 C(C(CCCC)CC)(=O)C1C=CC=C(OC)C=1
MCULE-3151744530 0.61 C1(C(C2=CC=C(C=C2)OC)CC(C(C)C)=O)C(=O)C2=C(C=CC=C2)C1=O
MCULE-8039471843 0.61 C(=O)(C1=CC=C(C=C1)OC1C=CC=CC=1)C1CCCCC1C(O)=O
MCULE-3115961651 0.61 C1(=CC(C)=CC=C1OC)C(C1CCCCC1)=O
MCULE-8413256371 0.61 C(=O)(CC(C)CC(C)(C)C)C1C=CC2=C(CCO2)C=1
MCULE-9481833990 0.61 C1(=CC=C(OC)C(OC)=C1)C(CCCCC(OC)=O)=O
MCULE-5905615089 0.61 C(O)(=O)CCC1=CC(OC)=C(OC)C=C1C(C)=O
MCULE-3732669181 0.61 C1(CC(OC)=O)C2CCC3C(=CC=C(OC)C=3)C2CCC1(C)C(OC)=O
MCULE-8875242687 0.61 C(=O)(CC1(CCCC1)CC(O)=O)C1=CC=C(OC)C(OC)=C1
MCULE-4105377786 0.61 C1(C=CC2=C(CCO2)C=1)C(C(CCCC)CC)=O
MCULE-6379438213 0.61 C12C=C(OC)C(=CC=1CCC(C[NH+](C)C)C2=O)OC.[Cl-]
MCULE-7713985486 0.61 C(C(CCCC)CC)(=O)C1C(C)=CC=CC=1C
MCULE-2200404473 0.61 C(C(CCC)CCC)(=O)C1=CC=CC=C1CC
MCULE-6327978239 0.61 C(C(CCC)CCC)(=O)C1=CC=CC(CC)=C1
MCULE-2488494459 0.61 C12C=C(O)C=CC=1C(C)CCC2
MCULE-4542033595 0.61 C1(C(C2CCCCC2)=O)=CC(C)=CC(C)=C1
MCULE-9684065082 0.61 C1(C=CC(=CC=1)O)C1CCC(CC1)=O
MCULE-3614181763 0.61 C1(C=CC=C(C(C)(C)C)C=1)C(C(CCC)CCC)=O
MCULE-7089246445 0.61 CC(C(=O)C1C=C(O)C(O)=CC=1)C
MCULE-1319727002 0.61 C1(C=CC=C(C(C)C)C=1)C(C(CCC)CCC)=O
MCULE-1049882752 0.61 C1(C=CC=CC=1C(C)C)C(C(CCC)CCC)=O
MCULE-3242545264 0.61 C(=O)(CC(C)CC(C)(C)C)C1C(C)=CC=CC=1C
MCULE-9910342066 0.61 C1(C(C2CCCCC2)=O)=CC=CC(C)=C1
MCULE-5555917000 0.61 C1(=CC=C(C(O)=C1)O)C(CC)=O
MCULE-3779285950 0.61 C12C=C(C=CC=1C(C)(C)CCC2(C)C)O
MCULE-2380271774 0.61 O=C1C2=C(C=CC=C2)CCC1
MCULE-8066527478 0.61 C1C(C(=O)O)C(C(=O)C2C(C)=CC=CC=2)CCC1
MCULE-7932280199 0.61 O=C1C2(CCC(CC2)=O)C(C)(C)C2C=CC=CC=21
MCULE-4109849905 0.61 C12CC(CC1)C1C(=O)C3C=CC=CC=3C21
MCULE-6073193498 0.61 C1(C2=CC=C(C(=O)C)C=C2O)CCCCC1
MCULE-8297674604 0.61 C1=CC(=CC(C(CCCCCC(=O)O)=O)=C1C)C
MCULE-8555552480 0.61 C1=CC(=CC(C(CCCCC(=O)O)=O)=C1C)C
MCULE-5819616687 0.61 C1(C(CCCC)=O)C=CC(=CC=1O)O
MCULE-3004059619 0.61 C1=CC(=CC(C(=O)CCCCCCC(=O)O)=C1C)C
MCULE-4297516159 0.61 C12=CC=C(OC)C(F)=C1CCCCC2=O
MCULE-4988381658 0.61 O=C(O)C1C=C2C(=O)CCCCC2=CC=1
MCULE-2090392148 0.61 C1(CC(CC(=O)C2C=CC=C(OC)C=2)CCC1)C(O)=O
MCULE-2667047875 0.61 C1CC(CC(=O)C2C=CC=C(OC)C=2)CCC1C(=O)O
MCULE-5915264852 0.61 C1CC(C(=O)C2C=C(OC)C=CC=2)CCC1C(=O)O
MCULE-5031527951 0.61 C1(=C(C)C=C(C)C(C)=C1)C(C1CCCC1)=O
MCULE-1601136791 0.61 C1(C(CCC2CCCC2)=O)=C(C)C=C(C)C(C)=C1
MolPort-046-509-757 0.61 CC1(C)CCC(=O)C2=CC(=CC=C12)C(O)=O
MolPort-005-939-079 0.61 CCCCC(=O)C1=CC(OC)=C(OC)C=C1
MolPort-046-690-456 0.61 CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@@](O)(C#C)[C@@]3(C)CC[C@H]21
MolPort-023-213-449 0.61 COC1=CC=C(C=C1)C(=O)[C@@H]1CCCC[C@H]1C(O)=O
MolPort-039-052-600 0.61 CC(C)C[C@H]([C@@H]1CC[C@@](C)(O)[C@@H]2[C@@H]3[C@H](CC[C@@]12C)C3(C)C)C1=C(O)C(C=O)=C(O)C(C=O)=C1O
MolPort-002-498-619 0.61 COC1=CC=C(C=C1)C(=O)[C@H]1CCCC[C@H]1C(O)=O
MolPort-003-803-551 0.61 COC1=CC=C(C=C1)C(=O)CC1(CCCCC1)C(O)=O
MolPort-009-765-895 0.61 Cl.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCCCN1CCCCC1
MolPort-000-723-687 0.61 [Cl-].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCCC[NH+]1CCCCC1
MolPort-039-338-955 0.61 COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC(=O)C5=C(C=O)C(O)=C(O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1
MolPort-002-800-305 0.61 CC(C)(C)CC(=O)C1=C(CC(C)(C)C)C=C(CC(C)(C)C)C=C1
MolPort-013-885-178 0.61 CCCCCC(=O)C1=CC(OC)=CC=C1
MolPort-046-764-496 0.61 [2H]C1=C(O)C([2H])=C2C(=C1)[C@H]1CC[C@]3(C)[C@@H](O)[C@H](O)[C@H](O)[C@H]3[C@@H]1CC2([2H])[2H]
MolPort-042-665-780 0.61 C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1[C@@H](O)[C@@H](O)[C@@H]2O
MolPort-013-885-177 0.61 CCCCCCC(=O)C1=CC(OC)=CC=C1
MolPort-000-872-106 0.61 COC1=CC=C(C=C1)C(=O)CC1C(=O)CC(C)(C)CC1=O
MolPort-001-835-772 0.61 COC1=CC=C(C=C1)C(CC(=O)C(C)C)C1C(=O)C2=CC=CC=C2C1=O
MolPort-003-933-880 0.61 CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
MolPort-046-690-035 0.61 C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CCC2(O)C#C
MolPort-022-893-760 0.61 CCC(=O)C1=C(C)C=C(O)C=C1
MolPort-020-000-860 0.61 CC(=O)C1=CC(O)=C(C=C1)C1CCCCC1
MolPort-006-115-212 0.61 CC1=CC(=CC=C1)C(=O)C1CCCCC1
MolPort-001-817-613 0.61 CC1(C)CCC(C)(C)C2=C1C=CC(O)=C2
MolPort-023-213-434 0.61 CC1=CC=CC=C1C(=O)[C@H]1CCCC[C@H]1C(O)=O
MolPort-023-213-445 0.61 CC1=CC=CC=C1C(=O)[C@@H]1CCCC[C@H]1C(O)=O
MolPort-001-793-713 0.61 OC1=CC=C(C=C1)C1CCC(=O)CC1
MolPort-009-756-355 0.61 CCC(=O)C1=CC(O)=C(O)C=C1
MolPort-002-818-070 0.61 CCCCC(=O)C1=C(O)C=C(O)C=C1
MolPort-046-691-068 0.61 O=C1CCC[13C]2=[13CH][13CH]=[13CH][13CH]=[13C]12
MolPort-001-759-824 0.61 O=C1CCCC2=CC=CC=C12
MolPort-000-159-540 0.60 OC(=O)C1=CC=C2C(=O)CCCC2=C1
MolPort-023-213-490 0.60 COC1=CC=C(C=C1)C(=O)[C@@H]1CC[C@@H](CC1)C(O)=O
MolPort-023-213-517 0.60 COC1=CC=C(C=C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O
MolPort-023-213-623 0.60 COC1=CC=C(C=C1)C(=O)C[C@H]1CC[C@H](CC1)C(O)=O
MolPort-023-213-648 0.60 COC1=CC=C(C=C1)C(=O)C[C@H]1CC[C@@H](CC1)C(O)=O
MolPort-000-154-675 0.60 COC1=C(OC)C=C(C=C1)C(=O)CCC(O)=O
MolPort-001-750-756 0.60 CCCOC1=CC(C)=C2CC[C@H](CC2=C1C)[C@H](C)C(O)=O
MolPort-039-338-832 0.60 CC(C)C1=CC2=C(C(O)=C1O)[C@@]1(C)CCCC(C)(C)C1=CC2=O
MCULE-8722053735 0.60 C12C(OC)=CC=C(OC)C=1CC(CCl)CC2=O
MolPort-035-681-682 0.60 CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
MolPort-008-756-200 0.60 COC1=C(O)C=C(C=C1)C(=O)CC(C)C
MolPort-026-854-268 0.60 COC1=CC=C(C(=O)CC(C)C)C(C)=C1
MolPort-002-467-495 0.60 OC(=O)CCC(=O)C1=CC2=C(CCCC2)C=C1
MolPort-002-254-115 0.60 COC1=CC=C(C=C1)C(=O)C12CC3CC(C1)CC(C3)(C2)C(=O)C1=CC=C(OC)C=C1
MolPort-029-939-508 0.60 CCC1CCC2=C(C1)C=CC=C2O
MolPort-003-937-377 0.60 OC1=CC=CC2=C1C(=O)CC2
MolPort-003-180-571 0.60 COC1=CC=C(CC2(CC(=O)C3=CC=CC=C3)C(=O)C3=CC=CC=C3C2=O)C=C1
MolPort-023-213-347 0.60 CC1=CC=C(C)C(=C1)C(=O)[C@H]1CCC[C@H]1C(O)=O
MolPort-002-521-935 0.60 COC1=CC=C(C=C1)C(=O)CCC1CCCCC1=O
MolPort-046-766-164 0.60 [2H]C1([2H])C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]2(C)C1([2H])OC(C)=O
MolPort-020-916-384 0.60 CCCC(=O)C1=CC=C(OC)C=C1C
MolPort-000-154-684 0.60 COC1=C(OC)C=C(C=C1)C(=O)CCCC(O)=O
MolPort-009-682-448 0.60 COC1=CC2=C(C=C1)C(=O)C(Br)CC2
MolPort-044-554-075 0.60 COC1=CC2=C(C=C1Br)C(=O)CCC2
MolPort-002-498-723 0.60 COC1=C(OC)C=C(C=C1)C(=O)CC(C)CC(O)=O
MolPort-006-798-115 0.60 COC1=C(C=O)C=C(C=C1)C12C[C@H]3C[C@H](C[C@H](C3)C1)C2
MolPort-046-765-786 0.60 O[C@H](CCC(O)=O)CC1=CC(O)=C(O)C=C1
MolPort-002-511-456 0.60 CC(=O)O[C@@H]1CC2C3CC(=O)C4=C(C=CC(OC(C)=O)=C4)C3CC[C@]2(C)C1OC(C)=O
MolPort-002-708-867 0.60 OC(=O)C1=CC(=CC=C1O)C12CC3CC(CC(C3)C1)C2
MolPort-020-963-459 0.60 CC1=CC(Br)=C(C)C2=C1CCCC2=O
MolPort-000-802-893 0.60 CC(=O)C1=CC(=CC2=C1CCC2(C)C)C(C)(C)C
MolPort-002-471-654 0.60 OC(=O)C12CC3CC(C1)CC(C3)(C2)C1=CC=C(O)C=C1
MolPort-001-763-620 0.60 CCCC1=C(O)C=CC(C(=O)CC)=C1O
MolPort-002-164-413 0.60 CCOC1=CC=C(CC2(CC(=O)C3=CC=CC=C3)C(=O)C3=CC=CC=C3C2=O)C=C1
MolPort-003-803-286 0.60 CC(=O)C1CCC2=C(C=CC=C2)C1=O
MolPort-023-213-485 0.60 CC1=CC=CC=C1C(=O)[C@@H]1CC[C@@H](CC1)C(O)=O
MolPort-023-213-468 0.60 COC1=CC(=CC=C1)C(=O)[C@H]1CCC[C@H](C1)C(O)=O
MolPort-001-793-851 0.60 OC1=C(C=CC2=CC=CC=C12)C(=O)CCCCCCCCC(=O)C1=C(O)C2=CC=CC=C2C=C1
MolPort-003-958-475 0.60 OC(=O)C1=CC(=CC=C1O)C1CCCCC1
MolPort-023-213-335 0.60 COC1=CC(=CC=C1)C(=O)[C@H]1CCC[C@H]1C(O)=O
MolPort-006-067-528 0.60 O=CC1CCC2=C(C=CC=C2)C1=O
MolPort-022-377-731 0.60 OC(=O)C1CCCC2=C1C=CC(O)=C2
MolPort-003-663-528 0.60 OC(=O)C1CC(=O)C2=CC=CC=C2C1
MCULE-7885569926 0.60 C1(C(CCC1)C(=O)O)C(C1C(C)=CC=CC=1C)=O
MCULE-1442334930 0.60 C(CCCCCCC(=O)C1=CC=C(C=C1)OC)(=O)C1C=CC(=CC=1)OC
MCULE-9843579158 0.60 C(=O)(CC(C)(C)CC(O)=O)C1=CC=CC=C1CC
MCULE-5197731278 0.60 C(=O)(CC(C)CC(C)(C)C)C1C=CC(=CC=1)OC
MCULE-1180571724 0.60 C(C(CCCC)CC)(=O)C1C=CC(=CC=1)OC
MCULE-1672777488 0.60 C(CCCCCCCC(=O)C1C=CC(=CC=1)OC)(=O)C1C=CC(=CC=1)OC
MCULE-8061172473 0.60 O=C1CCCC2=C1C=CC1=C2C=CC=C1
MCULE-4703522092 0.60 C1(C(C)=CC=CC=1C)C(CCC1CCCC1)=O
MCULE-8500422162 0.60 O=C1CCCC2C=CC3=C(C=21)C=CC=C3
MCULE-8422005092 0.60 C1=C2C3=C4C(C=C2)=C2C(C(=O)CCC2)=CC4=CC=C3C=C1
MCULE-5754636878 0.60 C1(C(C2CCCC2)=O)=C(C)C=CC=C1C
MCULE-5547013077 0.60 C(=O)(C1=CC(CCC)=CC=C1O)C
MCULE-6816748251 0.60 C1C[C@]23C(=O)O[C@H](C(=O)C4C=C(C(C)C)C(O)=C(O)C=42)[C@@]3([H])C(C)(C)C1
MCULE-9066768050 0.60 C1(C(=C2C(=CC=1OC)C(O)CCC2=O)O)CO
MCULE-3910474755 0.60 C12CCCC(=O)C1=CC=C(OC)C=2I
MCULE-1237388920 0.60 C1=CC2C(=O)C(C(C3C=CC(OC)=CC=3)C(C3C=CC(OC)=CC=3)C(C3C=CC(OC)=CC=3)=O)C(=O)C=2C=C1
MCULE-1745260232 0.60 C12(C)CCC3C(CCC4C=C(OCC=C)C=CC3=4)C1CCC2=O
MCULE-7472956863 0.60 C12(C)CCC3C(CCC4=CC(OC(C)=O)=CC=C34)C1CCC2=O
MCULE-1178040898 0.60 C1(C=CC2=C(CCO2)C=1)C(C(CCC)CCC)=O
MCULE-9391970342 0.60 C1(C(=O)C2=CC=C(C(OC)=C2)OC)C(=O)C2=C(C=CC=C2)C1=O
MCULE-2034831125 0.60 C1(=C(OC)C(=CC(C(CCCC(=O)O)=O)=C1)C)C
MCULE-5923284647 0.60 C1(C=C(C)C=CC=1OC)C(=O)CC(C)CC(C)(C)C
MCULE-3435930026 0.60 C(O)(=O)C1=C(O)C=CC=C1CCC1=CC=C(CCCCCCC)C=C1
MCULE-5322455309 0.60 C1(C)=C(OC)C=CC(=C1)C(CCCC(=O)O)=O
MCULE-7981010647 0.60 COC1C(O)=CC2C(CCC=2C=1)=O
MCULE-9316339398 0.60 C1(=CC(=CC=C1O)OC)C(CCCCCCC(=O)C1=CC(=CC=C1O)OC)=O
MCULE-3455643796 0.60 C1(C=C(C)C=CC=1OC)C(C(CCCC)CC)=O
MCULE-9353484946 0.60 C12=CC(OC)=CC=C1CC(C)C2=O
MCULE-2470029256 0.60 C1(=C(OC)C(C)=CC(=C1)C(CC(C)CC(=O)O)=O)C
MCULE-5854795687 0.60 C(=O)(C1C=CC(=CC=1)OCC)C1CCCCC1C(O)=O
MCULE-7306533423 0.60 C1(CC(CC1)C(O)=O)CC(=O)C1C=CC=C(OC)C=1
MCULE-4121966092 0.60 C1(=CC(OC)=CC=C1O)C(CCCCCCC)=O
MCULE-6062748524 0.60 C(=O)(C1C=CC(=CC=1)OC(C)(C)C)C1CCCCC1C(O)=O
MCULE-7518548601 0.60 C1(=CC(C)=CC=C1OC)C(CCCCCCCCCCC(=O)C1=CC(C)=CC=C1OC)=O
MCULE-7625619419 0.60 C1(=CC(=CC=C1O)OC)C(CCCCCCCC(=O)C1C=C(OC)C=CC=1O)=O
MCULE-5244533289 0.60 C1(=CC(OC)=CC=C1O)C(CCCCCCCCCCC(=O)C1=CC(OC)=CC=C1O)=O
MCULE-8394866767 0.60 OC(C1=CC2=C(C(CCC2)=O)C=C1)=O
MCULE-4767134635 0.60 C1(CC(CC(=O)C2C=CC(OC)=CC=2)CCC1)C(O)=O
MCULE-6362646190 0.60 C1CC(C(=O)C2C=CC(OC)=CC=2)CCC1C(=O)O
MCULE-1271906211 0.60 C(CCCC(=O)C1=CC=C(C=C1)OCCC)(=O)C1=CC=C(C=C1)OCCC
MCULE-7130595376 0.60 C1CC(CC(=O)C2C=CC(OC)=CC=2)CCC1C(=O)O
MCULE-6309328483 0.60 C1(=C(OC)C=CC(=C1)C(CC(C)(C(=O)O)C)=O)OC
MCULE-3296347344 0.60 COC1=C(OC)C=C(C(CCC(O)=O)=O)C=C1
MCULE-1679404992 0.60 C1(C=CC(=CC=1C)OC)C(CCC(OC)=O)=O
MCULE-7648269631 0.60 C1(C(C)=CC(=C(C)C=1)OC)C(=O)C(CC)C1C=CC=CC=1
MCULE-9240075788 0.60 C1C[C@@H]([C@@H](C(O)=O)C)CC2=C(C)C(OCCC)=CC(C)=C12
MCULE-8236030285 0.60 O=C1C(C[N+](C)(C)C)CCC2C=C(OC)C=CC=21
MCULE-3211131330 0.60 C(OCC)(=O)CC1(CC=C)CCC2=C(C1=O)C=CC(OC)=C2
MCULE-4732101109 0.60 C(OCC)(=O)CC1(CC(F)(F)F)CCC2=C(C1=O)C=CC(OC)=C2
MCULE-3761261850 0.60 C1(C)(CCC(C)C1(C)C)C(=O)C1C=C(C(=O)C2(C)CCC(C)C2(C)C)C=C(C(=O)C2(C)CCC(C)C2(C)C)C=1
MCULE-2294372720 0.60 C1(=CC(C)=CC=C1C)C(C1CCC1)=O
MCULE-8000647709 0.60 C1(C(C)=C(C)C=C(C)C=1C)C(C1CCC1)=O
MCULE-3303280282 0.60 CC1CC(C(C2=C(C)C=CC(C)=C2)=O)C1
MCULE-9759240906 0.60 C(C)(C1C=C(C(C)C)C(O)=CC=1C)=O
MCULE-5032971738 0.60 C1=C(O)C2C(=O)CCC=2C=C1
MCULE-3250265783 0.60 C1(CC(C(=O)C2C(C)=CC=C(C)C=2)CCC1)C(O)=O
MCULE-6622127605 0.60 C(=O)(CC1(CCCC1)CC(O)=O)C1=CC=CC=C1CC
MCULE-1820760443 0.60 OC(CCC(C1=CC2=C(CCCC2)C=C1)=O)=O
MCULE-2185441816 0.60 C1(C(CCCC(=O)C2C=CC(=CC=2O)C)=O)=CC=C(C=C1O)C
MCULE-6940750321 0.60 C1(C(CCC)=O)=CC=C(OC)C=C1C
MCULE-4565964124 0.60 C(=O)(CC1(CCCCC1)CC(O)=O)C1=CC(=CC=C1C)C
MCULE-3744123368 0.60 C1(C(CCC1)C(=O)O)C(C1C(C)=CC=C(C)C=1)=O
MCULE-5445495543 0.60 C1(C=CC(=CC=1C)OC)C(=O)C(C)(C)CC
MCULE-4489982978 0.60 C1(CC(CC1)C(=O)O)C(C1C(CC)=CC=CC=1)=O
MCULE-5638701414 0.60 C(O)(=O)CC1CC2=C(C1)C=CC=C2O
MCULE-5922405994 0.60 C(=O)(CC(C)C)C1C=CC(=CC=1C)OC
MCULE-6027624841 0.60 C1(C=CC(=CC=1C)OC)C(C(CC)CC)=O
MCULE-5672681832 0.60 C(=O)(CC(C)(C)C)C1C=CC(=CC=1C)OC
MCULE-2718093188 0.60 C(=O)(CCC1CCCCC1=O)C1=CC=C(C=C1)OC
MCULE-3338140829 0.60 C1(C=CC(=CC=1C)OC)C(C(C)CC)=O
MCULE-2000305180 0.60 COC1C=CC(C(CC(C)C)=O)=CC=1O
MCULE-3498995983 0.60 C[C@]12CC[C@]3([H])C4C=CC(O)=CC=4CC[C@@]3([H])[C@]1([H])CC[C@@H]2OC(=O)C
MCULE-5071019061 0.60 C1(=CC=C(OC)C(OC)=C1)C(C1CCC1)=O
MCULE-5257820565 0.60 C1(=CC=CC(C(=O)CCCCCCC(=O)O)=C1)OC
MCULE-8560411493 0.60 C1(=CC=CC(C(CCCCCC(=O)O)=O)=C1)OC
MCULE-4592464290 0.60 C1(=CC=CC(C(CCCCC(=O)O)=O)=C1)OC
MCULE-1645015113 0.60 C1(CC2C=CC(=CC=2)OC)(CC(C2=CC=CC=C2)=O)C(=O)C2=C(C=CC=C2)C1=O
MCULE-6670886964 0.60 C(=O)(CC(C)(C)CC(O)=O)C1=CC=C(OC)C(OC)=C1
MCULE-2085326163 0.60 C1(=C(OC)C=CC(=C1)C(CC(C)CC(=O)O)=O)OC
MCULE-2718989775 0.60 O=C1C2C=C(OC)C(OC)=CC=2CC21C(C1=C(C2)C=C(OC)C(OC)=C1)=O
MCULE-2218076538 0.60 COC1=C(OC)C=C(C(CCCC(O)=O)=O)C=C1
MCULE-3444070711 0.60 O=C1C2C=C(C(=CC=2CCC1)OC)Br
MCULE-1976849768 0.60 O=C1C2C=C(C(=CC=2CCC1)Br)OC
MCULE-8608996146 0.60 COC1C=CC2C(C(CCC=2C=1)Br)=O
MCULE-5606620394 0.60 C(C1C=CC=CC=1)(=O)OC1C=CC2=C(C=1)CCCCC2=O
MCULE-3748697775 0.60 C1(=O)C(C=O)CCC2=CC=CC=C12
MCULE-8812468231 0.60 C1(C(CCCCCBr)=O)C=C(C)C(=C(C)C=1)OC
MCULE-7390721811 0.60 C1(C(C2CCCC2)=O)=CC=CC(OC)=C1
MCULE-2544666438 0.60 C1(OC)=C(OC)C(=CC(C(=O)CCCCC(=O)O)=C1)OC
MCULE-6946202172 0.60 O=C1C2C(=C(C=C(C)C=2CCC1)Br)C
MCULE-8778378097 0.60 C1(C(C)=CC(=C(C)C=1)OC)C(=O)C(C)(C)C
MCULE-7366943855 0.60 [C@]12(C)CCC3C(CC(C4C=C(OC(C)=O)C=CC3=4)=O)C1C[C@@H](OC(C)=O)C2OC(C)=O
MCULE-3967847315 0.60 C1(CC2C=CC(=CC=2)OCC)(CC(C2C=CC=CC=2)=O)C(=O)C2C(=CC=CC=2)C1=O
MCULE-5356323138 0.60 C1=C(OC)C=CC(CCC(C2C(C)=C(C)C=CC=2)=O)=C1
MCULE-1789914376 0.60 C1(C=CC2=C(CCO2)C=1)C(C1CCCC1)=O
MCULE-7921984241 0.60 C12CCC(C)(C)C=1C=C(C(C)(C)C)C=C2C(C)=O
MCULE-6454073638 0.60 C1(=O)C2C=CC=CC=2CCC1C(C)=O
MCULE-4089827719 0.60 C1(C(CC)=O)=C(C)C=C(C(C)=C1)OC
MCULE-3667714275 0.60 C1(C(CCCCC(OC)=O)=O)C=C(C)C(=C(C)C=1)OC
MCULE-5783403674 0.60 C1(=CC(=CC=C1O)O)C(CCC)=O
MCULE-2828820186 0.60 C1(=CC=CC=C1CC)C(CCC(O)=O)=O
MCULE-1838703136 0.60 OC(C12CC3(C4=CC=C(O)C=C4)CC(C1)CC(C3)C2)=O
MCULE-9167871622 0.60 C1(=O)CC(CC2=CC=CC=C12)C(O)=O
MCULE-4686178593 0.60 C1(=C(O)C=CC(C2CCCCC2)=C1)C(O)=O
MCULE-3975810258 0.60 C1(=C(C)C=C(C(C)=C1)OC)C(C(C)C)=O
MCULE-6288539658 0.60 C1C(C(O)=O)C(CC(=O)C2C=CC=C(OC)C=2)CCC1
MCULE-3140355866 0.60 C1(O)C(CCC)=C(O)C=CC=1C(CC)=O
MCULE-6671566835 0.60 C1(OC)=C(C(=CC(C(=O)CCCCCC(=O)O)=C1)OC)OC
MCULE-9995434802 0.60 C1(OC)=C(C(=CC(C(=O)CCCCCCC(=O)O)=C1)OC)OC
MCULE-5171651759 0.60 C1(=CC=C(OC)C(C)=C1)C(CCCCC(OC)=O)=O
MCULE-6697699973 0.60 COC1C=C(C(C2C3(CC3)C2)=O)C=CC=1
MCULE-3956863938 0.60 C1(=CC=C(OC)C(C)=C1)C(CCCCCBr)=O
MCULE-7312859531 0.60 C(CCC1CCCC1)(=O)C1C=CC=C(OC)C=1
MCULE-2322030737 0.60 C1CC(CC(=O)C2C=CC=CC=2C)CCC1C(=O)O
MCULE-3711172064 0.60 C(CCCCCCCCC(C1=C(O)C2C=CC=CC=2C=C1)=O)(C1C=CC2C=CC=CC=2C=1O)=O
MCULE-4437663107 0.60 C1(C(CCC1)C(=O)O)C(C1C=C(OC)C=CC=1)=O
MCULE-3664565610 0.60 C1(=C(O)C=CC2=CC=CC=C12)C(CCCCCCCCCCC)=O
MCULE-7183157733 0.60 C12C=CC=CC=1C=CC(C(=O)CCCCCCCCCCCCCCCCC)=C2O
MCULE-5139185314 0.60 C1(=CC=C(OCC2=CC=CC=C2)C=C1C)C(C1CCCCC1)=O
MCULE-8418357621 0.60 C1CC(C(C2C(C)=CC=CC=2)=O)CCC1C(=O)O
MCULE-9998316788 0.60 C1(C=CC2=C(CCO2)C=1)C(CCC1CCCC1)=O
MCULE-5843879749 0.60 OC(C1C2=C(C=C(C=C2)O)CCC1)=O
MCULE-3820042472 0.60 C(=O)(CC1(CCCCC1)CC(O)=O)C1C=CC=C(OC)C=1
MCULE-7171573833 0.60 C1(CC(CC(=O)C2C=CC=CC=2C)CCC1)C(O)=O
MCULE-2715143877 0.60 C12CCCC=1C=C1CCCC1=C2C(C)=O
MCULE-1686689295 0.60 C1(CC(C(=O)C2C=C(OC)C=CC=2)CCC1)C(O)=O
MCULE-9979007964 0.60 C1C2(C3=CC(C(=O)O)=C(O)C=C3)CC3CC1CC(C2)C3
MCULE-9833342945 0.60 O=C1C(C[N+](C)(C)C)CCC2C=C(OC)C=CC=21.[I-]
MCULE-1286069318 0.60 C1C2CC3CC(C2)(C2C(O)=C(OC)C=C(C(=O)O)C=2)CC1C3
MCULE-3172954836 0.60 O=C(C1=CC2=C(OCCO2)C=C1)CC12CC3CC(C1)CC(C3)C2
MCULE-2731028474 0.60 C1(=CC=C2C(OCCO2)=C1)C(C1CCCCC1)=O
MCULE-5803661937 0.60 COC1=CC(C(CC(C2=C(C(O)=O)C=CC=C2)CC(C2=CC(OC)=CC=C2)=O)=O)=CC=C1
MCULE-3487608189 0.60 O(C1CCC2C1(C)CCC1C2CCC2C=C(O)C=CC=21)C(CCC1C=CC=CC=1)=O
MCULE-5288721059 0.60 C(O)(=O)C1CCC2C(=CC=C(OC)C=2)C1
MCULE-5320026380 0.60 O=C1C(C#N)(C)CCC2=C1C=CC1C=C(OC)C=CC=12
MCULE-1266708999 0.60 C1(C(CCC=C)=O)C(C)=CC(=C(C)C=1)OC
MCULE-4240423353 0.60 C1(=C(OC)C=CC(C(CCC(OC)=O)=O)=C1)C(C)(C)C
MCULE-9788594129 0.60 C12=CC=C(OC)C=C1CCC(C(O)=O)C2C
MCULE-1488362083 0.60 C(C(CCCC)CC)(=O)C1=CC=CC(OC(C)C)=C1
MCULE-4217491682 0.60 C1(=C(OC)C(=CC(C(CCC(=O)O)=O)=C1)C)C
MCULE-7811326526 0.60 C(=O)(C1C=CC(OC)=CC=1)C(CC)C1CCC(OC)CC1
MCULE-9446774704 0.60 C1(=C(OC)C(C)=CC(=C1)C(CC(C)(C(=O)O)C)=O)C
MCULE-4659221865 0.60 C(=O)(CC1CCC(OC)CC1)C1C=CC(OC)=CC=1
MCULE-6692874769 0.60 C12C(CCCC1=O)=CC=C(C(O)=O)C=2
MCULE-8347123273 0.60 C(=O)(CC(C)CC(C)(C)C)C1=CC=CC(OCC)=C1
MCULE-4067097267 0.60 C#CC1=CC=C2C(C(CCC2(C)C)=O)=C1
MCULE-3052461045 0.60 C(=O)(CC(C)CC(C)(C)C)C1=CC=CC(OC(C)C)=C1
MCULE-2542717191 0.60 C(CCC(CCC(O)=O)=O)(=O)C1C=CC(=CC=1)OC
MCULE-1993063493 0.60 C1(C=CC(=C(C)C=1)OC)C(CCC(O)=O)=O
MCULE-3423323896 0.60 C(C(CCCC)CC)(=O)C1=CC=CC(OCC)=C1
MCULE-7780758278 0.60 C1=CC(=CC=C1OC)C(=O)CCCCCCC
MCULE-1597624549 0.60 C1C=C(C(=O)CCCCCCCCCC)C=CC=1OC
MCULE-7749376749 0.60 C(CCCCC(=O)C1C=CC(=CC=1)OC)(=O)C1=CC=C(C=C1)OC
MCULE-3307105340 0.60 C1C(OC)=CC=C(C(CCCCCC)=O)C=1
MCULE-1435791916 0.60 [C@]12(C)CCC[C@@](C)(C(O)=O)C1CCC1C=C(C(C)C)C=CC2=1
MCULE-3664878756 0.60 C1(C(=O)CCCCCCCCCCC)C=CC(OC)=CC=1
MCULE-9225053135 0.60 C(CCCCCCCC)(=O)C1C=CC(=CC=1)OC
MCULE-4462573938 0.60 C12CCC3=C(C=CC(C(C)C)=C3)C1CCCC2(C)C(O)=O
MCULE-1653566703 0.60 C1(=CC=CC=C1CC)C(CCCC(O)=O)=O
MCULE-5876999286 0.60 [C@@]1(C)(C(O)=O)[C@]2([H])[C@@](C)(C3=C(CC2)C=C(C(C)C)C=C3)CCC1
MCULE-1951331389 0.60 C1C[C@]2(C)C3C=CC(C(C)C)=CC=3CC[C@@]2([H])[C@@](C(=O)O)(C)C1
MCULE-3231986709 0.60 C12(C)CCCC(C)(C(O)=O)C1CCC1C=C(C(C)C)C=CC2=1
MCULE-4043010777 0.60 [C@]12(C)CCC[C@@](C)(C(O)=O)[C@]1([H])CCC1C=C(C(C)C)C=CC2=1
MCULE-1312651020 0.60 C1C(OC)=CC=C(C(=O)CCCCCCCCC)C=1
MCULE-1005621642 0.60 C(CCCCCCCCCCCCC)(=O)C1C=CC(=CC=1)OC
MCULE-3626892334 0.60 C(CCCCC)(=O)C1C=CC(=CC=1)OC
MCULE-4777717602 0.60 C1(CC(C(=O)C2C(C)=CC=CC=2C)CCC1)C(O)=O
MCULE-5471293425 0.60 C(=O)(CC(C)CC(O)=O)C1=CC=CC=C1CC