SANC00947 3-Hydroxybenzoic acid



Download SMILES        
Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-3607182166 1 C(O)(=O)C1C=CC=C(O)C=1
MolPort-046-761-841 1 C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-008-322-122 1 C[C@@H]1CCC2[C@H](C)C(=O)O[C@@H]3O[C@]4(C)CCC1C23OO4
MolPort-046-765-276 1 C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-006-069-257 1 C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-006-392-383 1 [2H]C([2H])([2H])[C@@H]1[C@@H]2CC[C@@H](C)[C@@H]3CC[C@@]4(C)OO[C@@]23[C@H](OC1=O)O4
MolPort-002-493-751 1 C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-035-668-922 1 C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-001-741-431 1 C[C@@H]1CCC2[C@@H](C)C(=O)OC3O[C@]4(C)CCC1[C@@]23OO4
MolPort-046-761-841 1 C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-147-854 1 C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-765-277 1 C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-002-692-529 1 CC1CCC2C(C)C(=O)OC3OC4(C)CCC1C23OO4
MolPort-046-765-276 1 C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-035-668-922 1 C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-046-765-277 1 C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-046-147-854 1 C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MCULE-8536039620 0.97 C1(C(O)=O)=C2C(C=CC=C2)=CC(O)=C1
MCULE-8176501140 0.97 OC(C1C=C(O)C2C=CC=CC=2C=1)=O
MCULE-8042546089 0.97 [Na+].C([O-])(=O)C1=CC=CC(O)=C1
MCULE-8457226759 0.94 OC(C1C=CC=C2C=1C(=CC=C2)O)=O
MCULE-4985914989 0.94 C1(=CC2=CC=C(C=C2C(O)=C1)C)C(O)=O
MCULE-4631439955 0.94 C1(=CC(O)=CC(O)=C1)C(O)=O
MCULE-2583750305 0.92 C(O)(=O)C1C=CC(=C(O)C=1)C
MCULE-6111297909 0.92 CC1=CC(C(O)=O)=CC(O)=C1
MolPort-046-765-551 0.91 C[C@@H]1CC[C@H]2C(=O)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-765-551 0.91 C[C@@H]1CC[C@H]2C(=O)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MCULE-8964889860 0.89 C(O)(=O)C1=CC=C(C(O)=C1)O
MCULE-2450622052 0.89 O=C(C1C=C2C(C=CC(=C2)O)=CC=1)O
MCULE-7171470745 0.89 C1(=CC(O)=CC=C1O)C(O)=O
MCULE-2831330137 0.89 CC1C=CC(O)=CC=1C(=O)O
MCULE-5691151631 0.89 C1=CC(C(=O)O)=C(O)C(O)=C1
MCULE-9675424040 0.89 C12C=CC(=CC=1C=CC=C2C(O)=O)O
MCULE-6274989380 0.89 C1C=C(O)C(=C(C(=O)O)C=1)C
MCULE-6715690340 0.89 C(O)(=O)C1C=CC(=C(O)C=1)C=O
MolPort-006-069-124 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-027-949-008 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-006-392-384 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-688-543 0.88 [2H]C([2H])(C(O)=O)C([2H])([2H])C(=O)O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-001-732-325 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-042-675-791 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MolPort-044-193-509 0.88 CC1CCC2C(C)C(OC(=O)CCC(O)=O)OC3OC4(C)CCC1C23OO4
MolPort-027-949-008 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-042-675-791 0.88 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-688-543 0.88 [2H]C([2H])(C(O)=O)C([2H])([2H])C(=O)O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-044-193-509 0.88 CC1CCC2C(C)C(OC(=O)CCC(O)=O)OC3OC4(C)CCC1C23OO4
MCULE-2110265546 0.87 C1(C2C=CC=CC=2C=C(O)C=1O)C(O)=O
MCULE-2441895054 0.87 C1(C=CC(=CC=1O)C(O)=O)C(O)=O
MCULE-1631519503 0.87 C1(C=C(O)C=CC=1O)C(=O)[O-].[Na+]
MCULE-2532999005 0.87 OC(C1=C(O)C2=C(C=CC=C2)C(O)=C1)=O
MCULE-5412822699 0.87 OC(C1=CC(C(O)=O)=CC(O)=C1)=O
MCULE-5444497653 0.87 C1(C)C(O)=CC(=CC=1O)C(=O)O
MCULE-4871945782 0.86 C(O)(=O)C1C=CC2=C(C=CC(O)=C2)C=1
MolPort-046-688-567 0.86 C[C@@H]1CC[C@H]2C(=C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-765-296 0.86 C[C@H]1CC[C@H]2C(=C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-046-765-296 0.86 C[C@H]1CC[C@H]2C(=C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-046-688-567 0.86 C[C@@H]1CC[C@H]2C(=C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MCULE-3895789288 0.85 C1(C(O)=O)C(O)=CC(=C(O)C=1)C
MCULE-7033772308 0.85 [Na+].[Na+].[Na+].C1(C(=O)[O-])C=C([O-])C2=C(C=CC=C2)C=1[O-]
MCULE-1552954312 0.85 C1(O)C(O)=CC(=CC=1O)C(O)=O
MCULE-8415570065 0.85 O=C(C1C(O)=C(O)C(C(=O)O)=CC=1)O
MCULE-6998700569 0.85 C1(C(O)=O)=C(O)C=C(C(O)=C1)C(O)=O
MCULE-7701244928 0.85 C(OC)(=O)C1=CC=CC(O)=C1
MCULE-3573784841 0.85 CC1=C(O)C(O)=C(C(O)=O)C=C1
MCULE-1893902174 0.84 C(=O)C1=CC=C(CO)C=C1O
MCULE-3810579265 0.83 C1=C2C(C=CC=C2)=C(O)C=C1C(OC)=O
MCULE-4022798357 0.83 C1C(C(=O)[O-])=C(C=C(C(=O)[O-])C=1O)O.[Na+].[Na+]
MCULE-3802946118 0.83 C1(C=O)C(=CC=CC=1C(O)=O)O
MCULE-8665297037 0.83 C1(C(=O)O)=CC(=C(O)C=C1C)O
MCULE-4193677899 0.83 OC1=CC=CC(O)=C1.OC(C1=CC=CC=C1)=O
MCULE-4342449875 0.83 OC1=C(C=C(C=C1C(=O)O)O)O
MCULE-6224615106 0.83 C1=CC(O)=C(C)C(C(O)=O)=C1O
MCULE-5749310287 0.83 C1(O)C(O)=CC(=CC=1O)C(=O)[O-].[Na+]
MCULE-9062424386 0.82 CC1=CC(O)=C(C(O)=O)C=C1
MCULE-9133006477 0.82 C1(C(O)=O)C(O)=CC2=C(C=C(C=C2)O)C=1
MCULE-1155406232 0.81 C12=CC=C(C=C1C=CC(O)=C2C)C(O)=O
MCULE-9355450041 0.81 [N+]([H])([H])([H])[H].C([O-])(=O)C1=CC=CC=C1O
MCULE-2205929978 0.81 C(O)(=O)C1=CC=CC(OC)=C1
MCULE-9503421715 0.81 C1(C=C(O)C=C(O)C=1)C(OC)=O
MCULE-8183013546 0.81 C1(C(=O)O)=CC=CC=C1O.C=O
MCULE-5550217438 0.81 C1(=CC(C)=CC(O)=C1O)C(O)=O
MCULE-8407868694 0.81 C1(=CC=CC=C1O)C(O)=O
MCULE-1367764897 0.81 C(O)(=O)C1C=CC(=CC=1)O
MCULE-5341041647 0.81 C1(=CC2=CC=C(C=C2C(O)=C1)OC)C(O)=O
MCULE-7176393688 0.80 C1=CC=C(C)C(C(O)=O)=C1O
MCULE-2477279031 0.80 C1(=CC=C(C=C1C)O)C(O)=O
MCULE-2237159154 0.80 C1(=CC=CC2C=CC=C(O)C1=2)C(OC)=O
MCULE-8997323102 0.79 O=C(C1C=CC=C2C=1C=C(C=C2)O)O
MCULE-2125757137 0.79 C1(=C(C=CC=C1C(O)=O)O)C(O)=O
MCULE-7826774363 0.79 C1=C2C(C=CC=C2)=C(OC)C=C1C(O)=O
MCULE-2900979171 0.79 [Na+].C1(C=CC(O)=CC=1)C([O-])=O
MCULE-9774378658 0.79 OC(C1=C(O)C2=C(C=CC=C2)C=C1)=O
MCULE-9768249873 0.79 C1(C=CC(=C(O)C=1O)O)C(O)=O
MCULE-3278681377 0.79 C1(=CC2=CC=C(C=C2C(O)=C1)F)C(O)=O
MCULE-6366909615 0.79 C1C(O)=CC=C(C(=O)O)C=1C(=O)O
MCULE-1857214652 0.79 C12=CC=CC(O)=C1C=CC=C2C(O)=O
MCULE-4070039799 0.79 C1(C=CC2C(=CC=C(C(O)=O)C=2O)C=1O)C(O)=O
MCULE-1778914318 0.79 C1(CO)C=C(C=O)C=C(O)C=1O
MCULE-5692760882 0.79 C1(=CC2=CC=C(C=C2C(O)=C1)Cl)C(O)=O
MCULE-7122569137 0.79 O=CC1C=CC=C(O)C=1
MCULE-4218919872 0.79 OC(C1=C2C(C=CC=C2)=C(O)C=C1)=O
MCULE-5539162624 0.79 C(OCC)(=O)C1=CC=CC(O)=C1
MCULE-5336529746 0.79 OC(C1C=CC2C=CC(=CC=2C=1O)O)=O
MCULE-6591947606 0.79 C1=C(C=CC2=CC=CC(O)=C12)C(O)=O
MCULE-3211614773 0.79 C1(C(O)=O)=C(O)C=C2C(C=CC=C2)=C1
MCULE-6546362277 0.79 C1(C(O)=O)=CC2C=CC=C(O)C=2C=C1O
MCULE-1439462293 0.79 NC1=C(O)C=C(C(O)=O)C=C1
MCULE-6830189735 0.79 C1(=C(O)C=CC2=CC=CC=C12)C(O)=O
MCULE-6517641542 0.79 COC(C1=CC(O)=C(C)C=C1)=O
MCULE-9680609713 0.78 C1(C(O)=O)=C(O)C=C(C=C1O)C
MCULE-6806137604 0.78 C1C(O)=CC(C)=C(C(O)=O)C=1C
MCULE-2369636558 0.78 O=CC1C=C(O)C(C)=CC=1
MolPort-035-868-724 0.78 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-069-207 0.78 C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-019-940-201 0.78 CC1CCC2C(C)C(O)OC3OC4(C)CCC1C23OO4
MolPort-001-732-329 0.78 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-001-732-326 0.78 C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-001-732-330 0.78 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-035-868-724 0.78 C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-689-504 0.78 [2H]C([2H])([2H])[C@H]1[C@@H](O)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3
MolPort-046-069-207 0.78 C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-044-729-899 0.78 C[C@@H]1CCC2[C@@H](C)[C@@H](O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MolPort-023-220-349 0.78 C[C@@H]1CCC2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-019-940-201 0.78 CC1CCC2C(C)C(O)OC3OC4(C)CCC1C23OO4
MolPort-044-729-899 0.78 C[C@@H]1CCC2[C@@H](C)[C@@H](O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
MolPort-046-689-504 0.78 [2H]C([2H])([2H])[C@H]1[C@@H](O)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3
MolPort-009-198-667 0.78 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
MolPort-023-220-349 0.78 C[C@@H]1CCC2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-003-983-866 0.78 C[C@@H]1CCC2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-9511101474 0.77 C1(CO)C=C(C=C(O)C=1O)C(O)=O
MCULE-7230659975 0.77 O=C(C1C=C(O)C(C=O)=CC=1)OC
MCULE-2299008175 0.77 O=C(C1C=C2C(C=CC(=C2)O)=CC=1)OC
MCULE-1178445402 0.77 C1(=CC=CC(O)=C1N)C(O)=O
MCULE-9084723627 0.77 C(O)(C1C(O)=CC=C(O)C=1C(O)=O)=O
MCULE-8205352159 0.77 C1(O)C=C(C(=O)OC)C=CC=1O
MCULE-2088622210 0.77 C1(C=C(O)C=CC=1N)C(O)=O
MCULE-3211816894 0.77 C(O)(=O)C1=CC=C(CC)C(O)=C1
MCULE-2449589163 0.77 C1(COC(C2=CC=CC(O)=C2)=O)=CC=CC=C1
MCULE-1077910751 0.77 C1(O)C=C(C(=O)O)C(O)=CC=1O
MCULE-5109167030 0.77 C1(C=O)=C2C(C=CC=C2)=CC(O)=C1
MCULE-5880277905 0.77 C1(C=C2C=CC(=CC2=C(O)C=1)OCC)C(O)=O
MCULE-5807326870 0.77 C(OC)(=O)C1C=CC(=C(O)C=1)CO
MCULE-8368669409 0.77 C1=C2C(C=CC=C2)=C(O)C=C1C(OCC)=O
MCULE-6594456778 0.77 C1(C(O)=CC2C(=CC=CC=2)C=1)C(=O)[O-].[Na+]
MCULE-1315888838 0.77 C1(C=CC=C2C=CC=C(OC)C=12)C(O)=O
MCULE-6451301219 0.77 COC1C=CC2C=CC(C(=O)O)=CC=2C=1
MCULE-3452221838 0.77 C1(O)C=C(C=CC=1C(C)C)C(O)=O
MCULE-8457767983 0.77 C(=O)(OC(C)C)C1C=CC=C(O)C=1
MCULE-4925309953 0.77 C1(O)=C2C(C=C(O)C=C2)=CC=C1C(O)=O
MCULE-3297401011 0.77 COC(C1C=C(O)C=C(C)C=1)=O
MCULE-6547861565 0.77 C1=C2C=CC=C(C(=O)O)C2=CC=C1OC
MCULE-1114504762 0.77 C1(=C(C=CC=C1O)O)C(O)=O
MolPort-023-223-358 0.77 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC3OC(C(O)C(O)C3O)C(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1C23OO4
MolPort-046-765-754 0.77 C[C@H]1CC[C@@H]2[C@@H](C)C(O[C@@H]3OC([C@H](O)C(O)C3O)C(O)=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-023-223-358 0.77 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC3OC(C(O)C(O)C3O)C(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1C23OO4
MolPort-046-765-754 0.77 C[C@H]1CC[C@@H]2[C@@H](C)C(O[C@@H]3OC([C@H](O)C(O)C3O)C(O)=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4
MolPort-023-220-418 0.76 CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-023-220-418 0.76 CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-046-761-838 0.76 [2H]C([2H])([2H])O[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3
MolPort-046-688-617 0.76 CO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-046-688-618 0.76 [2H]C([2H])([2H])O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-023-220-124 0.76 CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-046-761-839 0.76 CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3
MolPort-039-142-118 0.76 COC1OC2OC3(C)CCC4C(C)CCC(C1C)C24OO3
MCULE-2014607078 0.76 OC(C1=CC(O)=C(Br)C=C1)=O
MCULE-5040193554 0.76 Cl.C(O)(=O)C1=CC=CC(O)=C1N
MCULE-4423318476 0.76 C1=C(C(O)=O)C=C(O)C=C1C(C)(C)C
MCULE-1530359404 0.76 C(O)(=O)C1=CC=C(C(O)=C1)OC
MCULE-1465044626 0.76 C1(O)C(Cl)=CC=C(C(=O)O)C=1
MCULE-1054587835 0.76 C1(=CC(OC)=CC(O)=C1)C(O)=O
MCULE-6453476467 0.76 C(O)(=O)C1C=CC(=C(O)C=1)F
MCULE-6710240272 0.76 C(O)(=O)C1=CC=C(C(O)=C1)I
MCULE-1953241622 0.76 OC1=CC(C(OCC2=CC=C(COC(C3=CC(O)=CC=C3)=O)C=C2)=O)=CC=C1
MCULE-7422472216 0.76 O=C(C1C(F)=CC=C(O)C=1)O
MCULE-5572220045 0.76 O=C(C1C(I)=CC=C(O)C=1)O
MCULE-9847223620 0.76 C1(=CC(C)=CC(OC)=C1)C(O)=O
MCULE-8095921204 0.76 O=C(C1C(Cl)=CC=C(O)C=1)O
MCULE-7074343589 0.76 OCC1=CC(O)=CC=C1
MCULE-8312886415 0.76 O=C(C1=C(F)C(O)=CC=C1)O
MCULE-4404255049 0.76 O=C(C1=C(Cl)C(O)=CC=C1)O
MCULE-9065940615 0.76 OC(C1C=CC=C(O)C=1Br)=O
MCULE-8379757966 0.76 C1(C)=C(O)C=C(C=C1O)C(OC)=O
MCULE-2328340530 0.76 C1(C=CC=C(O)C=1C)C(OC)=O
MCULE-7067944963 0.76 C1(C=C(O)C=C(O)C=1)C(OCC)=O
MCULE-4712009137 0.76 C1(C=CC(=CC=1O)C(OC)=O)C(O)=O
MCULE-7432305245 0.76 C(O)(=O)C1C=CC=C(OCC)C=1
MCULE-6155994918 0.76 NCC1=C(O)C=C(C(O)=O)C=C1
MCULE-9690857120 0.76 C1(C=C(O)C=CC=1Br)C(O)=O
MCULE-6448869128 0.76 OC(C1=CC(O)=C(C#N)C=C1)=O
MCULE-8489322972 0.76 COC(C1=C(C)C=CC(O)=C1)=O
MCULE-1033889179 0.76 C1(C=C(O)C=CC=1O)C(OC)=O
MCULE-1237499741 0.76 C1(O)=C(O)C(C(=O)OC)=CC=C1
MCULE-3189776967 0.76 CC(C1C=CC(C(=O)O)=CC=1O)=O
MolPort-046-761-839 0.76 CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3
MolPort-039-142-118 0.76 COC1OC2OC3(C)CCC4C(C)CCC(C1C)C24OO3
MolPort-046-688-618 0.76 [2H]C([2H])([2H])O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-016-633-324 0.76 CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-023-220-124 0.76 CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-046-761-838 0.76 [2H]C([2H])([2H])O[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3
MolPort-001-732-355 0.76 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCCCCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-046-688-617 0.76 CO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
MolPort-001-732-359 0.75 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC3CCCCC3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-363 0.75 CCC(C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3
MolPort-001-732-367 0.75 C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(O)=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4
MolPort-001-732-372 0.75 CC(C)CNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3
MCULE-6293106254 0.75 C(O)(=O)C1C=CC2C(=CC=C(OC)C=2)C=1
MCULE-3899251551 0.75 C(OC)(=O)C1C=CC2=C(C=CC(O)=C2)C=1
MCULE-8837486794 0.75 C1C=C2C(C(O)=C(C(O)=O)C=C2)=CC=1C
MCULE-1416247523 0.75 [Na+].C1(C([O-])=O)C(O)=CC=CC=1O
MCULE-5737099017 0.75 CC1C=C(O)C=C(C=O)C=1
MCULE-7890756003 0.75 C1(C=CC=C(C)C=1O)C(O)=O
MCULE-3087026244 0.75 C1(C=C(O)C=C(C=O)C=1)O
MCULE-5364202477 0.75 C1(C(O)=O)C(O)=CC2=C(C=CC=C2)C=1O
MCULE-1571508815 0.74 C12C(=CC=CC1=C(O)C=C(C(O)=O)C=2)OC
MCULE-5519467331 0.74 COC(C1=CC(C(OC)=O)=CC(O)=C1)=O
MCULE-4396537843 0.74 COC1=CC(C(O)=O)=CC(OC)=C1
MCULE-9497825728 0.74 C12=C(C=CC=C1C(O)=CC(C(O)=O)=C2)F
MCULE-1630891729 0.74 C1(O)=CC(CO)=CC2=CC=CC=C12
MCULE-2156257966 0.74 C1(O)=C(C=O)C=CC(C=O)=C1O
MCULE-6067220779 0.74 COC1=C(C)C=CC(C(O)=O)=C1
MCULE-2052079039 0.74 C12=C(C=CC=C1C(O)=CC(C(O)=O)=C2)Cl
MCULE-5362031663 0.74 CC1=C(C)C(O)=C(C(O)=O)C=C1
MCULE-6277481986 0.74 C12=CC(OC)=C(C=C1C(=CC(C(O)=O)=C2)O)OC
MCULE-1508898218 0.74 C1(C=C2C=CC=CC2=C(OCC)C=1)C(O)=O
MCULE-1873741163 0.74 C1(C=O)=CC(O)=C(C=C1O)C=O
MCULE-4467353796 0.74 C(O)(C1=CC=CC=C1)=O
MCULE-6223979353 0.74 O=C(C1C=C(F)C=C(O)C=1)O
MCULE-3785714526 0.74 C1(C(C)=CC=C(C)C=1O)C(O)=O
MCULE-6665844871 0.74 O=C(C1C=C(O)C=C(C(=O)OC)C=1)O
MCULE-3000799509 0.74 C1(=CC(CO)=CC(OC)=C1)C(O)=O
MCULE-8056457911 0.74 C1(=CC=C(C=C1O)C(OC)=O)C(OC)=O
MCULE-9327583357 0.74 COC(C1C=C(O)C2C=CC=CC=2C=1O)=O
MCULE-7409704402 0.74 C(O)(=O)C1=CC=CC(OC(C)C)=C1
MCULE-9438567274 0.74 C1(C=O)=C2C(C=CC=C2O)=CC=C1
MCULE-6346495103 0.74 O=C(C1C=CC=CC=1)[O-].[NH4+]
MCULE-1710358524 0.74 C(O)(=O)C1=CC(I)=CC(O)=C1
MCULE-4669527775 0.74 C1(C=C(O)C=C(N)C=1)C(O)=O
MCULE-8967911171 0.74 C(O)(=O)C1=CC(O)=CC(Br)=C1
MCULE-4626719858 0.74 C1(O)=C(O)C=C(C=C1O)C(OC)=O
MCULE-3349858536 0.74 C(O)(=O)C1C=CC=C(C=1)OC(C)(C)C
MCULE-2553675826 0.74 Cl.NCC1=C(O)C=C(C(O)=O)C=C1
MolPort-001-732-361 0.73 C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NC(C)(C)CO)O[C@H]3OC4(C)CC[C@@H]1C23OO4
MCULE-9188655658 0.73 C1(C=O)C=C(O)C=CC=1O
MCULE-1772179274 0.73 C1(C=O)=CC(O)=CC(C=O)=C1
MCULE-5696684135 0.73 CC1=CC(C(O)=O)=C(O)C=C1
MCULE-2634918730 0.73 CC1=CC(C(O)=O)=C(O)C(C)=C1
MCULE-5858576352 0.73 O=C(C1C(C)=CC(O)=C(C)C=1)O
MCULE-3010957407 0.73 O=C(C1C(C)=C(C)C(O)=CC=1)O
MCULE-7994934490 0.73 O=C(C1C(O)=CC(C=O)=CC=1)OC
MCULE-9332636114 0.73 N(CC)CC.OC1=CC=CC=C1C(=O)O
MCULE-2799864839 0.73 C1(C)C(=CC=CC=1C=O)O
MCULE-9710774046 0.73 C(O)(=O)C1C=CC(=C(C)C=1)O
MCULE-7312286851 0.73 C([O-])(=O)C1=CC=CC(C)=C1O.[Na+]
MCULE-3567468095 0.73 C1(C(O)=O)=C(O)C=C(C(C)=C1)C
MCULE-4376220579 0.73 C1(C=C(C(O)=C(C)C=1)C)C(O)=O
MCULE-4515195536 0.73 C1(O)C(=CC=CC=1C=O)O
MCULE-4404427908 0.73 C1=CC(C)=CC(O)=C1C=O
MCULE-4186608531 0.73 C1(=CC=CC(C=O)=C1O)C(O)=O
MCULE-8201140117 0.73 C1(O)=CC(=CC=C1O)C=O
MCULE-5722964358 0.73 OC1=CC=C(C)C(C=O)=C1
MCULE-8529143358 0.72 CCC1C(O)=CC=CC=1C(=O)O
MCULE-8678586833 0.72 C(OCC)(=O)C1=CC=C(C=O)C(O)=C1
MCULE-3339201501 0.72 COC1=C(C(O)=O)C=C(O)C=C1
MCULE-9418313797 0.72 C1C(O)=CC(=CC=1O)CO
MCULE-9181060649 0.72 C(OCC)(=O)C1=CC=C(O)C(O)=C1
MCULE-3032518976 0.72 O=C(C1C=C2C(C=CC(=C2)OC)=CC=1O)O
MCULE-4379320758 0.72 C1(Br)=C(O)C=C(C=C1O)C(O)=O
MCULE-8687628141 0.72 C(O)(=O)C1C=CC=C(C=1)OC1=CC=CC(=C1)C(O)=O
MCULE-8166988742 0.72 O=C(C1C=C(O)C=C(C)C=1)OCC
MCULE-9908985450 0.72 C1(C=O)=C2C(C=CC=C2)=C(C=O)C(O)=C1O
MCULE-5053935612 0.72 C1(C(=O)OC)C=C(C(C(=O)OC)=CC=1O)O
MCULE-8340999832 0.72 C1(C=CC=C(OC)C=1C)C(O)=O
MCULE-9103573737 0.72 C1(=CC(O)=CC=C1C(C)(C)C)C(O)=O
MolPort-000-781-823 0.72 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CC(O)=O)C3CCOC(C)(C)C3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-8897212575 0.72 C1(CN)=CC(O)=CC(C(=O)O)=C1
MolPort-001-732-343 0.72 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(C)(C)C(O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-8285343829 0.72 C(OC)(=O)C1=CC=CC(OC)=C1
MolPort-035-669-084 0.72 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCCN3CCCC3=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-9834304679 0.72 C1(=CC(=CC=C1O)OC)C(O)=O
MolPort-035-669-084 0.72 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCCN3CCCC3=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-4243288791 0.72 C(OC)(=O)C1=CC(O)=C(C)C=C1O
MCULE-4630178194 0.72 C(O)(=O)C1C=CC=C(OC2=CC=CC=C2)C=1
MCULE-2667517874 0.72 C(O)(=O)C1=CC=C(C(OC)=C1)O
MCULE-5017280586 0.72 C1(C=CC(=C(O)C=1O)C(OC)=O)C(OC)=O
MCULE-5432489221 0.72 C1(C=C(O)C=C(Cl)C=1)C(O)=O
MCULE-9335930091 0.72 C1(=CC(OC)=CC=C1C)C(O)=O
MCULE-3059435873 0.72 C1(I)C(O)=CC(=CC=1O)C(O)=O
MCULE-8846212787 0.72 C1(=CC(OC)=CC(C(O)=O)=C1)C(O)=O
MCULE-2260095973 0.72 COC1=C(O)C(C(O)=O)=CC=C1
MCULE-8192772474 0.72 CCCOC(C1=CC(O)=CC=C1)=O
MCULE-1917707590 0.72 Cl.C1(C=C(O)C=C(N)C=1)C(O)=O
MCULE-4116889430 0.72 COC1=C(OC)C=C2C(C=CC(C(O)=O)=C2)=C1
MCULE-5715688876 0.72 OC(C1=CC(O)=C(C(F)(F)F)C=C1)=O
MolPort-001-732-360 0.71 COC(CNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)OC
MolPort-001-732-353 0.71 CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-001-732-357 0.71 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-381 0.71 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-3056170168 0.71 OC(C1=C2C(C=CC=C2)=CC2=C1C=CC=C2)=O
MCULE-2178663400 0.71 C12=CC=C(C=C1C=CC(O)=C2C)C(OC)=O
MCULE-3047851108 0.71 C1(O)C=C(C)C(C(O)=O)=C(O)C=1
MCULE-8611747037 0.71 C(O)(C1C2C3C=CC=CC=3C=CC=2C=CC=1)=O
MCULE-5005535040 0.71 C1=C2C3=C(C4C5=C(C=CC=C52)C(C(O)=O)=CC=4)C=CC=C3C(C(O)=O)=C1
MCULE-4091694113 0.71 C(O)(=O)C1=CC=C(CO)C(OC)=C1
MCULE-6163074623 0.71 C([O-])(=O)C1=CC=C(O)C(OC)=C1.[Na+]
MCULE-1942326291 0.71 O=C(C1=CC=CC=C1)[O-].[Ag+]
MCULE-5368262482 0.71 C(OC)(=O)C1C=CC(=CC=1)O
MCULE-3354461241 0.71 OC(C1=CC2=C(C=CC=C2)C=C1)=O
MCULE-9729899661 0.71 C1(C=CC(=CC=1O)C(OCC)=O)C(O)=O
MCULE-6562853006 0.71 CCOC1=C(O)C=C(C(O)=O)C=C1
MCULE-8084123477 0.71 C1(C(O)=O)=CC2C=CC=CC=2C2=CC=CC=C12
MCULE-3381154283 0.71 C1(C=C(C)C=C(OCC)C=1)C(O)=O
MCULE-8804952070 0.71 C1C=C2C=C3C4C=CC=CC=4C=C(C(O)=O)C3=CC2=CC=1
MCULE-4937633334 0.71 C1(C(=O)O)C=CC2C3C=CC=CC=3C=CC=2C=1
MCULE-8546433349 0.71 CC(OC(C1=CC(O)=C(O)C=C1)=O)C
MCULE-8903350308 0.71 C1(CO)=CC(C)=CC(C=O)=C1O
MCULE-2817118589 0.71 C12C=CC3C4=C(C=CC(C=CC=1C(O)=O)=C24)C=CC=3
MCULE-9766627438 0.71 C1(=CC(=CC=C1O)O)C(OCC)=O
MCULE-7050391980 0.71 OC(C1C(O)=C(C(=O)O)C=CC=1)=O
MCULE-8411449236 0.71 C1(C=CC(=CC=1O)O)C(O)=O
MCULE-9873907838 0.71 C1(C(O)=O)C(O)=CC(=CC=1O)O
MCULE-6273599367 0.71 C1(C(O)=O)=CC2C=CC=CC=2C(C=O)=C1O
MCULE-6302190823 0.71 C12C3=C4C=CC=C3C=CC1=CC(C(O)=O)=CC=2C=C4
MCULE-8352621550 0.71 C1C(C(O)=O)=CC2C3C=CC=CC=3C=CC=2C=1
MCULE-3922201853 0.71 C1(C(=O)OC)=C(O)C(O)=CC(O)=C1
MCULE-5810404838 0.71 C1C=C(C2C=CC(C(=O)O)=CC=2)C=C(O)C=1
MCULE-4764729842 0.71 C1=C2C(C=CC=C2)=C(OC)C=C1C(OC)=O
MCULE-6645466243 0.71 C(O)(=O)C1C=CC2=C(C=CC(=C2)C(O)=O)C=1
MCULE-8593827530 0.71 O=C(O)C1C=C2C(C=C3C(=C2)C=CC=C3)=CC=1
MCULE-4595251630 0.71 C12C=C3C=CC(=CC3=CC1=CC=C(C=2)C(O)=O)C(O)=O
MCULE-9749393037 0.71 COC(C1=C(O)C=C(C)C=C1)=O
MCULE-2213595582 0.71 C(O)(=O)C1C=CC2C(=CC=C(C)C=2)C=1
MCULE-6390930517 0.71 C(O)(C1=CC2C=CC=CC=2C2=C1C=CC1C=CC=CC=12)=O
MCULE-2483299934 0.71 C1=C(O)C(C=O)=CC(CO)=C1
MCULE-3833908854 0.71 O=C(C1=C(F)C(O)=CC=C1F)O
MCULE-9291111411 0.71 C(O)(C1C2C=CC=CC=2C2=C(C=1)C=CC1C=CC=CC=12)=O
MCULE-9870683312 0.71 C12=CC(=CC3=CC=CC(=C13)C1C3C(=CC=CC2=3)C=C(C(O)=O)C=1)C(O)=O
MCULE-9704780709 0.71 C(O)(C1=CC2C=CC3=C(C=2C=C1)C1C=CC=CC=1C=C3)=O
MCULE-5212855510 0.71 C1(=CC=CC2C=CC=CC1=2)C(O)=O
MolPort-001-732-347 0.70 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CO)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-376 0.70 CC(C)CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-001-732-358 0.70 CCC(C)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-001-732-366 0.70 CC(C)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-000-797-186 0.70 CC(C)CC(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-000-786-575 0.70 CCC(C)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MCULE-1064203595 0.70 O=C(C1C=CC=C2C=1C=C(C=C2)O)OC
MCULE-4402897242 0.70 [Na+].[O-]C1C=CC(C(=O)OC)=CC=1
MCULE-1623982025 0.70 [Na+].C1(C=CC(=CC=1O)O)C(=O)[O-]
MCULE-3675606002 0.70 CC(C1=CC(O)=C(C(O)=O)C=C1)C
MCULE-3532185208 0.70 OC1C(O)=CC(CO)=CC=1
MCULE-6697709540 0.70 C12C(C=CC=C1)=C(O)C=CC=2C(OC)=O
MCULE-7030858292 0.70 CCC1=CC(O)=C(C(O)=O)C=C1
MCULE-5857559273 0.70 CC1C(CO)=CC=CC=1O
MCULE-4430317595 0.70 COC(C1=C(C)C=C(O)C=C1)=O
MCULE-8473693653 0.70 C(CO)[N+](C)(C)C.C1(C([O-])=O)C=CC=CC=1O
MCULE-5640096727 0.70 C(O)(=O)C1C=CC(=C(CO)C=1)O
MCULE-2903379688 0.70 C1(C=O)=CC(CO)=C(C=C1O)C
MCULE-8641178639 0.70 CC(C1C=CC(C(=O)O)=C(O)C=1)(C)C
MCULE-4039067194 0.70 C([O-])(C1=C(O)C=C(O)C=C1O)=O.[K+]
MCULE-6764344404 0.70 C(O)(=O)C1=CC(CO)=CC=C1O
MCULE-4032143775 0.70 C12=CC=C(C=C1C=CC(OC)=C2C)C(O)=O
MCULE-4780936161 0.70 C1(=CC(=CC=C1O)C=O)C(O)=O
MCULE-7627915900 0.70 C(O)(=O)C1=CC=C(C=C1)OC
MCULE-9186038381 0.70 C1(C(OC)=O)=C2C(C(O)=CC=C2)=CC=C1
MCULE-2715180362 0.70 C1(C=O)C(O)=CC=C(C=1)C(O)=O
MCULE-5398249325 0.70 C1(=CC=CC=C1O)C(OC)=O
MCULE-9687977373 0.70 C(OCC)(=O)C1C=CC2=C(C=CC(O)=C2)C=1
MCULE-2295754423 0.70 C1(C(O)=CC2=CC=C(OC)C=C2C=1)C(=O)[O-].[Na+]
MolPort-001-732-384 0.69 CC(C)[C@H](NC(=O)CCCNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O
MolPort-001-732-370 0.69 CC(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-001-732-369 0.69 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CCC(N)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-339 0.69 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CCCC3C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-035-669-075 0.69 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N(C)CC(O)C(O)C(O)C(O)CO)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-000-804-023 0.69 CC(C)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-001-732-349 0.69 CC(O)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-035-669-075 0.69 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N(C)CC(O)C(O)C(O)C(O)CO)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-9298482933 0.69 C12C=CC(=CC1=CC=C(O)C=2)C=O
MCULE-8549128932 0.69 C1(C=O)C(O)=CC(C)=CC=1O
MCULE-9885454652 0.69 C(=O)(O)C1=CC=C(CO)C=C1
MCULE-2960554549 0.69 C(O)(=O)C1C=CC(=CC=1)C=O
MCULE-5756067990 0.69 O=C(C1C=CC=C2C=1C=CC(=C2)C)O
MCULE-6555770999 0.69 O=C(C1C(C)=C(O)C=CC=1)OCC
MCULE-7037457289 0.69 C(O)(=O)C1C=CC=C(OC2=CC=C(O)C=C2)C=1
MCULE-2108800864 0.69 C(O)(=O)C1C=CC(=C(OC)C=1)OC
MCULE-6940210490 0.69 C12C=CC=CC1=CC=C(C([O-])=O)C=2.[Na+]
MCULE-4718177714 0.69 OC(C1=CC=C(C(C2=CC(O)=CC=C2)=O)C=C1)=O
MCULE-8909791929 0.69 O=C(C1C(C)=C(O)C(O)=CC=1)OC
MCULE-5929013920 0.69 C(OC)(=O)C1=CC(C)=CC(O)=C1C
MCULE-9763091773 0.69 CC(OC(C1=C(O)C=CC(O)=C1)=O)C
MCULE-5315661614 0.69 C(O)(=O)C1C=CC=C(OC2C=CC(=CC=2)C)C=1
MCULE-1252007794 0.69 C1(O)=C(OC(C)(C)C)C=CC(C(=O)O)=C1
MCULE-5980242854 0.69 C1(O)=C(O)C=C(C=O)C=C1O
MCULE-8091178078 0.69 C1(O)C(O)=CC(=CC=1O)C(OCC)=O
MCULE-8333140792 0.69 COC(C1=CC2=CC=CC(O)=C2C=C1O)=O
MCULE-4816574520 0.69 C(O)(=O)C1=CC=CC(OCCC)=C1
MCULE-3044719672 0.69 C(O)(=O)C1=CC=CC(=C1)OCC(C)C
MCULE-8504441271 0.69 C1(=CC=C2C(C=C(C=C2)OC)=C1O)C(O)=O
MCULE-9542254904 0.69 OC(C1=CC(C(F)(F)F)=CC(O)=C1)=O
MCULE-2646735432 0.69 C(O)(=O)C1=CC=C2C(C=C(C=C2)C(O)=O)=C1
MCULE-4715229328 0.69 C1C=C(C(=C(C=1)O)O)C(=O)OCC
MCULE-4152356645 0.69 C1(C=C(C)C=C(OC(C)C)C=1)C(O)=O
MCULE-9289682931 0.69 OC(C1=CC=C(C(O)=O)C=C1)=O
MCULE-4404323662 0.69 C(OC)(=O)C1=CC=C(N)C(O)=C1
MCULE-7952118759 0.69 CCOC(C1=CC(C(OCC)=O)=CC(O)=C1)=O
MCULE-6746939490 0.69 OC1C=CC(O)=C(C=1)C(=O)OCC1C=CC=CC=1
MCULE-5453750222 0.69 C12C=CC=CC1=C1C=C3C4C=CC=CC=4C=C(C(=O)O)C3=CC1=C(C(O)=O)C=2
MCULE-2497536187 0.69 C(O)(=O)C1C=CC(=CC=1)C
MCULE-3339713723 0.69 O=C(C1C=C(OC2C=CC(OC)=CC=2)C=CC=1)O
MolPort-035-669-082 0.68 CCOC(=O)C1CCCN(C1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MolPort-001-732-374 0.68 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC3CCCO3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-000-807-934 0.68 CC(O)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-035-669-082 0.68 CCOC(=O)C1CCCN(C1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MCULE-2420193887 0.68 [K+].CC1C=CC(C(=O)[O-])=CC=1
MCULE-1971631194 0.68 COC1=C(C)C(OC)=CC(C(O)=O)=C1
MCULE-4907732481 0.68 C12C(=CC=CC=1C(O)=O)C=CC(OC)=C2
MCULE-1832339031 0.68 C1=C2C(C(C(O)=O)=C3C(=C2C(O)=O)C=CC=C3)=CC=C1
MCULE-3746895762 0.68 O=C(C1C(OC)=CC(C(=O)O)=CC=1)O
MCULE-1942481637 0.68 O=C(C1C=C(O)C=C(OC)C=1)OC
MCULE-2399006363 0.68 C1(=C(O)C=CC2C=CC=CC1=2)C(=O)OC
MCULE-4418363875 0.68 COC1=C(C)C(C(O)=O)=CC(C)=C1
MCULE-5133308405 0.68 C1(C(=O)O)=C(O)C=C(CN)C=C1
MCULE-1079660937 0.68 C1(=CC=C(C([O-])=O)C=C1)C([O-])=O.[Na+].[Na+]
MCULE-8963740577 0.68 C(O)(=O)C1=CC=CC(=C1)OCC1=CC=CC=C1
MCULE-3455780959 0.68 C(OC)(=O)C1=CC=C(C(O)=C1)OC
MCULE-2731153470 0.68 O=C(C1=C(Cl)C(O)=C(Cl)C=C1)O
MCULE-3576934926 0.68 CCOC1=C(C)C=CC(C(O)=O)=C1
MCULE-7741331613 0.68 OC(C1C=CC(F)=C(O)C=1F)=O
MCULE-6741432668 0.68 OC(C1=CC=CC=C1)=O.OC(C1=CC=CC=C1)=O.OC(C1=CC=CC=C1)=O.OC(C1=CC=CC=C1)=O.OCC(CO)(CO)CO
MCULE-3198454818 0.68 COC(C1C(C)=CC(O)=CC=1C)=O
MCULE-6916567075 0.68 C1(C(=O)O)=CC(=C(O)C(O)=C1)Br
MCULE-8662697935 0.68 C(O)(=O)C1C=CC=CC=1C
MCULE-7488482596 0.68 C1(C(OC)=O)=C(O)C=C(C=C1O)C
MCULE-5873944067 0.68 COC1=CC(C(O)=O)=C(OC)C=C1
MCULE-8088080668 0.68 C1(C=C(C=C(O)C=1C)N)C(O)=O
MCULE-6487494991 0.68 C(OC)(=O)C1=CC=CC(OCC)=C1
MCULE-4060559854 0.68 C1(C)C=C(O)C=CC=1C=O
MCULE-2516193990 0.68 OC(C1=C(F)C=CC(O)=C1O)=O
MCULE-5568997402 0.68 C(O)(C1C=CC=CC=1)=O.C(O)CN
MCULE-7954114887 0.68 C1(C=C(OCC)C=CC=1O)C(O)=O
MCULE-7102050358 0.68 C1(C(OCC)=O)=C(O)C=C(C(O)=C1)C(OCC)=O
MCULE-4019398749 0.68 C1(=O)C2=CC(O)=CC3=CC=CC(C(=O)O1)=C23
MCULE-4594452651 0.68 O=C(C1C(Br)=CC(C)=C(O)C=1)O
MCULE-2848109556 0.68 C1(C(O)=O)C(Br)=C(O)C=C(O)C=1Br
MCULE-8230881692 0.68 CC(OC1=CC(C(O)=O)=CC=C1)=O
MCULE-4979064355 0.68 OC(C1=C(C(F)(F)F)C=CC(O)=C1)=O
MCULE-3537114564 0.68 C(C1C2C3C(=CC=CC=3C=CC=2C=CC=1)C(O)=O)=O
MCULE-2361312239 0.68 COC1C2C=CC=C(C(O)=O)C=2C=CC=1
MCULE-4864820261 0.68 OC(C1=C(O)C=C(C#N)C=C1)=O
MCULE-4020231266 0.68 C1(C=CC(=C2C=CC=CC=12)OC)C(O)=O
MCULE-5451649610 0.68 C(C1=C(O)C=CC=C1)([O-])=O.C(C1=C(O)C=CC=C1)([O-])=O.[N+](CC[N+]([H])(C)C)([H])(C)C
MCULE-8870593749 0.68 C(O)(=O)C1=CC=CC(OC(C)CC)=C1
MCULE-8836758458 0.68 C1(C(=O)O)=C2C(C=CC=C2)=C(C(=O)O)C=C1
MCULE-3714231810 0.68 C1(C(O)=O)C(O)=CC(=C(CO)C=1)C
MCULE-3763692161 0.68 C(O)(=O)C1=CC=CC(OC2CC2)=C1
MCULE-2443510541 0.68 C12=C(OC)C(OC)=CC=C1C(=CC(C(O)=O)=C2)O
MCULE-3552094936 0.68 C1(C)C(O)=CC(=CC=1F)C(O)=O
MCULE-1014757882 0.68 C12=C(OC)C=C(C=C1C(=CC(C(O)=O)=C2)O)OC
MCULE-8655746464 0.68 OC1C(C=O)=C(C)C=CC=1
MCULE-4121996029 0.68 C1(C(=C(C(=O)OC)C=CC=1O)O)O
MCULE-4699644155 0.68 C1(O)=CC(C)=CC=C1CO
MCULE-2723104150 0.68 C1=CC2C=CC=C(C(=O)O)C=2C=C1C(=O)O
MCULE-2177723101 0.68 C(OCC)(=O)C1=CC=CC(OC)=C1
MCULE-2353723456 0.68 C1C=C(C2=C(C=1)C(C(O)=O)=CC=C2)C(O)=O
MCULE-1025734955 0.68 CC1=C2C(C(C(O)=O)=CC=C2)=CC=C1
MCULE-1108502896 0.68 C(O)(=O)C1=CC(O)=C(C)C=C1F
MCULE-9764882149 0.68 C(=O)(OC(C)C)C1C=C(O)C(=C(O)C=1)O
MCULE-8440059313 0.68 C1(C=CC(=CC=1C)OC)C(O)=O
MCULE-1072072725 0.68 C1(C(OC)=O)C(O)=CC2=CC=CC=C2C=1
MCULE-6880864736 0.68 C1C=C(C(C(O)=O)=CC=1OC)CO
MCULE-3046310729 0.68 C1(=CC(OCC)=CC(OCC)=C1)C(O)=O
MCULE-7010908522 0.68 COC(C1=C(O)C2=C(C=CC=C2)C=C1)=O
MCULE-5518878908 0.68 C1(O)C=C(C=CC=1C(C)C)C(OC)=O
MCULE-8058685171 0.68 C1(C=C(C)C=C(C)C=1)C(O)=O
MCULE-2479860066 0.68 C(OC)(=O)C1C=CC2C(=CC=C(OC)C=2)C=1
MCULE-3587930243 0.68 CC1=CC(COC(C2=CC(O)=C(C)C=C2)=O)=CC=C1
MCULE-1148233944 0.68 O=C(C1C=C(O)C(O)=C(OC)C=1)O
MCULE-3349880842 0.68 C1C=C2C(=CC=1)C(C)=CC=C2C(=O)O
MCULE-6198574048 0.68 O=C(C1C(N)=CC(O)=C(O)C=1)O
MCULE-8632144278 0.68 C(O)(=O)C1=CC=CC(C)=C1
MCULE-3420307726 0.68 COC(C1C(C)=CC=CC=1O)=O
MCULE-1235261556 0.68 C1(=CC(OC)=CC=C1C=O)C(O)=O
MCULE-1361574162 0.67 C1(=CC=CC(O)=C1)C(=O)OC1C=CC=CC=1
MCULE-7510021793 0.67 COC1C=C(CO)C=CC=1C(=O)O
MCULE-4063147878 0.67 C(O)(=O)C1=CC=CC(OCCF)=C1
MCULE-4138566501 0.67 C(O)(=O)C1C=CC=C(C=1)OCC1C=CC(C)=CC=1
MCULE-5865856183 0.67 C1(OCC)C=CC=C(C(=O)O)C=1O
MCULE-8358316345 0.67 C1(C=CC=CC=1OC)C(O)=O
MCULE-6314465100 0.67 C1(O)C(OC)=CC(=CC=1OC)C(O)=O
MolPort-001-732-373 0.67 COC(=O)C1CCCN1C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3
MCULE-1659406510 0.67 OC(C1=CC(C(O)=O)=C(O)C=C1)=O
MCULE-6369820478 0.67 C1(F)C(O)=CC(C(OC)=O)=CC=1
MCULE-6734145650 0.67 C(O)(=O)C1=CC=CC(OCCOC2C=CC=CC=2)=C1
MCULE-7644333124 0.67 O=C(C1C(OC)=C(O)C=CC=1O)O
MCULE-9909760314 0.67 CC(=O)C1C=C(O)C=C(C)C=1
MCULE-7933280538 0.67 C1(C(O)=O)C(C)=C(C)C(=C(C)C=1O)O
MCULE-1143839155 0.67 C1(C=CC(=C(C)C=1O)O)C(O)=O
MCULE-8080444223 0.67 C1(C(O)=O)=C(I)C=C(C(O)=C1I)I
MCULE-9973195350 0.67 O=C(C1C(F)=C(O)C=C(F)C=1)O
MCULE-6782708879 0.67 C(F)(F)(F)OC1C=CC=C(C=1)C(O)=O
MCULE-6927036997 0.67 O=C(C1C(F)=CC(F)=C(O)C=1)O
MCULE-7450511248 0.67 O=C(C1C(Cl)=C(O)C(O)=CC=1)O
MCULE-4197408041 0.67 C1C(O)=CC(=C(C=1C)C=O)C
MCULE-1346550329 0.67 C1C(C2C=CC(C)=CC=2)=CC(O)=C(C(O)=O)C=1
MCULE-1345016694 0.67 C1(=CC(C)=CC=C1C(O)=O)OC
MCULE-5208595798 0.67 C1=C(C(=O)O)C(F)=C(F)C=C1O
MCULE-9860151482 0.67 C1C(C)=C(C(O)=O)C(C)=CC=1OC
MCULE-2807848719 0.67 C(O)(=O)C1=CC=C(C(OCC)=C1)O
MCULE-5572370168 0.67 C1(C(=O)O)C=CC(OC)=C(O)C=1O
MCULE-6301100712 0.67 C(=O)C1=CC=C(CO)C=C1
MCULE-6481266924 0.67 C(OC)(=O)C1=CC=CC(OC(C)C)=C1
MCULE-1687241947 0.67 C1(C(O)=O)=C(Br)C=C(C(O)=C1Br)Br
MCULE-6859774253 0.67 CC(C1C=CC(C(OC)=O)=CC=1O)=O
MCULE-5039428679 0.67 C1(COC)C=C(C=O)C=C(O)C=1O
MCULE-2062381823 0.67 COCC1=CC(O)=CC=C1
MCULE-2817103795 0.67 C1(=CC(O)=CC=C1C1C=CC(=CC=1)O)C(O)=O
MCULE-8732873366 0.67 C(O)(C1=CC(OC(C)C)=CC(OC(C)C)=C1)=O
MCULE-8046799262 0.67 O(C)C1=C(C(=O)O)C=C(C2C=CC=CC=21)OC
MCULE-7744722297 0.67 C(O)(=O)C1C=CC=C(C=1)OC(F)F
MCULE-3788300475 0.67 O=CC1=CC=C(C=C1)O
MCULE-5632097355 0.67 C1(O)C(C=O)=CC=C(C)C=1C
MCULE-7405504502 0.67 OC1=CC(C(OCC2=CC=C(C3=CC=CC=C3)C=C2)=O)=CC=C1
MCULE-9627446691 0.67 C1(COC)C=C(C=C(O)C=1O)C(O)=O
MCULE-6039197048 0.67 C1(C=CC=C(OC)C=1OC)C(O)=O
MCULE-5013904613 0.67 O=CC1C(O)=CC(C)=CC=1C
MCULE-8965879140 0.67 C1(C=CC=CC=1O)C=O
MCULE-7483859772 0.67 C1(C(O)=O)C=C(C=C(C)C=1O)C(O)=O
MCULE-9913987180 0.67 C(O)(=O)C1=CC(O)=C(Br)C=C1Br
MCULE-7916834597 0.67 CC(OC1=CC(C(O)=O)=C(C)C=C1)C
MCULE-8223138825 0.67 COC1=C(O)C(C(O)=O)=CC(C)=C1
MCULE-2897757224 0.67 C(OC)(=O)C1C=CC(=C(O)C=1)Br
MCULE-1651267747 0.67 C(O)(=O)C1=CC=CC(OCCN)=C1
MCULE-1027512763 0.67 C12C(=CC=C(C(C)C)C=1)C=C(C=C2OC)C(O)=O
MCULE-8324182114 0.67 COCCOC1=CC(C(O)=O)=CC=C1
MCULE-4684911950 0.67 CC1=C(O)C=C(C(OCC2=C(C)C=CC=C2)=O)C=C1
MCULE-9783852818 0.67 NC1=CC(C(O)=O)=C(O)C(O)=C1
MCULE-4006219801 0.67 C1(=CC(C)=C(C(OC)=C1)O)C(O)=O
MCULE-9384280387 0.67 C1(C=CC=C(O)C=1N)C(OC)=O
MCULE-1172444562 0.67 OC(C1=CC=C(C2=CC=C(O)C=C2)C=C1)=O
MCULE-9963925518 0.67 C1(O)=C(O)C=C(C=C1N)C(O)=O
MCULE-3533740523 0.67 OC1=CC2=C(COC2=O)C=C1
MCULE-3144313587 0.67 C1(C=O)=C(C)C=CC(C)=C1O
MCULE-9159916328 0.67 C1C(C(OC)=O)=CC(O)=C(O)C=1CO
MCULE-9835235442 0.67 COC(C1=CC(OC)=CC(OC)=C1)=O
MCULE-9268354968 0.67 C(O)(=O)C1C=CC=C(OCC=C)C=1
MCULE-4748833139 0.67 C1(C(O)=O)=C(C)C=C(C(C)=C1O)O
MCULE-2364965129 0.67 C1(C=C(C)C=C(OC)C=1)C(OC)=O
MCULE-5959531785 0.67 C(OC)(=O)C1=CC=C(C(O)=C1)Cl
MCULE-3732144253 0.67 C1=C2C(C=CC=C2)=C(OC(C)=O)C=C1C(O)=O
MCULE-4355528880 0.67 C1(C(=CC=CC=1O)O)C(OC)=O
MCULE-2715104358 0.67 C(O)(=O)C1=CC=C(C=C1)OCC
MCULE-2295965519 0.67 O=C(O)C1C(O)=CC(C2C=CC=CC=2)=CC=1
MCULE-6964982759 0.67 C1(C(=O)O)=CC=CC(OCC2C=CC=C3C=CC=CC=23)=C1
MCULE-8431429231 0.67 C1(=CC=CC(O)=C1)C(C)=O
MCULE-2212183250 0.67 COC(C1=C(N)C=CC(O)=C1)=O
MCULE-4964679586 0.67 C(OC)(=O)C1C=CC(=C(OC)C=1)C
MCULE-1112559786 0.67 C1(=CC(=CC(O)=C1C)Br)C(O)=O
MCULE-1416260692 0.67 C(OC)(=O)C1=CC=C(C(O)=C1)C#N
MCULE-7863784257 0.67 C(OC)(=O)C1=CC=C(C(O)=C1)I
MCULE-6157064953 0.67 CC(OC1=CC2=C(C=CC=C2)C(C(O)=O)=C1)=O
MCULE-4906467392 0.67 C(OCC)(=O)C1C=CC(=CC=1)O
MCULE-4954380096 0.66 O=CC1=CC=CC(OC)=C1
MCULE-6709371235 0.66 C12=CC(C)=CC=C1C(=CC1=C(C=CC=C12)C)C(O)=O
MCULE-2886194385 0.66 OC1C=C(C)C(CO)=CC=1
MCULE-8224350131 0.66 C1(C=CC=C2C=CC=C(C=O)C=12)C(O)=O
MCULE-8761337912 0.66 C12C=CC=CC=1C(O)=C(C=O)C(C=O)=C2O
MCULE-8413029459 0.66 C1=C(C=C(C(=O)O)C=C1)C=O
MCULE-4185692233 0.66 C1(C=O)=C(C)C=C(C(C)=C1)O
MCULE-7915259665 0.66 OC(C1=CC(Br)=C(O)C=C1)=O
MCULE-9588773001 0.66 C12C=CC(=CC=1C=CC(O)=C2)CO
MCULE-4565421128 0.66 C1(=C(C)C=CC2=CC=CC=C12)C(O)=O
MCULE-3651636508 0.66 C1C2=CC=CC=C2C(C)=C(C(=O)O)C=1
MCULE-4625432394 0.66 C1C(C=O)=C(O)C(O)=C(O)C=1
MCULE-3866798280 0.66 OCC1=CC(C(O)=O)=CC=C1
MCULE-7221534928 0.66 [O-]C(C1C=CC(=CC=1)C(=O)[O-])=O.[N+](C)(C)(C)C.[N+](C)(C)(C)C
MCULE-3851149128 0.66 C1=CC2C(C)=CC=C(C(=O)O)C=2C=C1C
MCULE-8413339458 0.66 OC1C(CO)=C(C)C=CC=1
MCULE-7451113963 0.66 C12C(CO)=CC=CC1=CC=CC=2C(=O)O
MCULE-5446094801 0.66 CC1=C(C(O)=O)C(C)=CC=C1
MCULE-7438757672 0.66 COC1=CC(C=O)=C(C(O)=O)C=C1
MolPort-035-669-081 0.66 CCOC(=O)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MolPort-001-732-396 0.66 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CC(N)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-402 0.66 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)NCC(O)=O
MolPort-001-732-397 0.66 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C(C)C)C(O)=O
MolPort-000-822-469 0.66 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C)C(O)=O
MolPort-000-818-994 0.66 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NCC(O)=O
MolPort-001-732-388 0.66 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CC(O)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-400 0.66 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C)C(O)=O
MolPort-001-732-389 0.66 CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O
MolPort-001-732-354 0.66 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CC(O)CC3C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-387 0.66 CCC(C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O
MolPort-000-810-918 0.66 CC(C)CC(NC(=O)C(CC(C)C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-000-794-589 0.66 CCC(C)C(NC(=O)C(CC(C)C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O
MolPort-000-814-947 0.66 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C(C)C)C(O)=O
MolPort-000-814-189 0.66 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CCC(O)=O)C(O)=O
MolPort-001-732-334 0.66 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-403 0.66 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CCC(O)=O)C(O)=O
MolPort-035-669-081 0.66 CCOC(=O)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MolPort-001-732-362 0.66 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCC3=CCCCC3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-6362456767 0.65 O=C(C1C(Cl)=C(O)C=CC=1)OC
MCULE-5000751623 0.65 C1(C(O)=CC(C(O)=O)=CC=1O)CC1C(O)=CC(C(O)=O)=CC=1O
MCULE-8680471350 0.65 O=C(C1C(CC)=CC=CC=1O)O
MCULE-9400625776 0.65 C(F)(F)(F)COC1=CC=CC(=C1)C(O)=O
MCULE-3185639384 0.65 CCOC(C1C=C(O)C2C=C(C=CC=2C=1)F)=O
MCULE-8868138651 0.65 C(O)(=O)C1C=CC=C(C=1)OCC(F)F
MCULE-4633975543 0.65 C(=O)(C1C=CC(=CC=1)O)OC(C)C
MCULE-5274398631 0.65 C1(=CC(=CC=C1O)O)C(OCCC)=O
MCULE-6362386507 0.65 O=C(C1C=C(Cl)C(O)=C(O)C=1)O
MCULE-5460621271 0.65 C(C1=C([O-])C=CC=C1)(=O)[H].[Na+]
MCULE-9494694529 0.65 C1(=CC=C(C=C1O)C(F)(F)F)C(O)=O
MCULE-5137124682 0.65 C1(C(C)=CC=CC=1OC)C(O)=O
MCULE-4258727292 0.65 COC(C1C=C(C(C)(C)C)C=C(O)C=1)=O
MCULE-9515105679 0.65 C1=C(C(O)=O)C(=CC(=C1OC)C(=O)O)OC
MCULE-5813372639 0.65 C1(C(C)(C)C)=CC=C(C=O)C=C1O
MCULE-9551333858 0.65 C[C@@H](C1=CC(O)=CC=C1)O
MCULE-6589732445 0.65 C(OC)(=O)C1C=CC(=C(OC)C=1)O
MCULE-9721171462 0.65 O=C(C1C=CC(OCC)=C2C=1C=CC=C2)O
MCULE-7541128592 0.65 C(O)(=O)C1C=CC(=CC=1)OC1C=CC=C(C)C=1
MCULE-3942629189 0.65 C(=O)(OCC1C=CC=CC=1)C1=CC=C(C=C1)O
MCULE-6750342306 0.65 C1(C(O)=O)=C(C(C)C)C=C(O)C=C1
MCULE-8294591738 0.65 C1(C=CC2=CC=CC=C2C=1OC)C(O)=O
MCULE-9776503567 0.65 C(O)(=O)C1=CC=C(C=C1)COC1=CC=CC(CO)=C1
MCULE-2298026072 0.65 C1(=CC(O)=CC=C1F)C(OC)=O
MCULE-5454965295 0.65 C1(C=O)=C2C(C(O)=CC=C2)=CC=C1
MCULE-3103307174 0.65 C1(=CC(C)=CC(OCCC)=C1)C(O)=O
MCULE-1756105077 0.65 OC(C1=CC(O)=C(N(=O)=O)C=C1)=O
MCULE-8841900294 0.65 COC1C=C2C(C=CC=C2O)=CC=1C(O)=O
MCULE-2515553968 0.65 C1(C=CC=C(O)C=1)C(C)(C)O
MCULE-8730812736 0.65 OC1=CC(C(OCCCOC(C2=CC(O)=CC=C2)=O)=O)=CC=C1
MCULE-7632124321 0.65 C1(C=CC=C(Br)C=1O)C(O)=O
MCULE-9392113985 0.65 C[C@H](C1=CC(O)=CC=C1)O
MCULE-5716573708 0.65 C1(=CC(Br)=CC=C1O)C(O)=O
MolPort-001-732-332 0.65 CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)c1ccccc1
MCULE-8770447797 0.65 O(C)C1=C(C=C(C(=O)OC)C=C1O)O
MolPort-035-669-074 0.65 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NN3CCOCC3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-9546860048 0.65 C(O)(=O)C1C=CC(=C(OC)C=1)N
MolPort-001-732-395 0.65 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CO)C(O)=O
MCULE-1158178258 0.65 O=CC1=CC=CC(=C1)OCC1C=CC=C(OC)C=1
MolPort-000-784-725 0.65 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C(C)O)C(O)=O
MCULE-9530175649 0.65 C1=CC(OC)=C2C=C(OC)C(C(=O)O)=CC2=C1
MolPort-000-784-323 0.65 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CO)C(O)=O
MCULE-5000376480 0.65 C1(C(O)=O)=C(OC)C=C(C(OC)=C1)C
MolPort-001-732-382 0.65 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C(C)O)C(O)=O
MCULE-9115150332 0.65 C1(C(O)=O)C(O)=CC(=C(CO)C=1)O
MolPort-035-669-074 0.65 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NN3CCOCC3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-6821662628 0.65 CCOC(C1=CC(O)=C(N)C=C1)=O
MCULE-7195712243 0.65 OC(C1=C(O)C=CC(OC2=CC=CC=C2)=C1)=O
MCULE-7651752053 0.65 CC(OC1=CC=C(C(O)=O)C=C1)(C)C
MCULE-8600137822 0.65 C1(=CC2=CC=C(C=C2C(OC)=C1)F)C(O)=O
MCULE-3128044978 0.65 CC(C1=CC(O)=CC=C1)O
MCULE-4267663971 0.65 C1(=CC2=CC=C(C=C2C(OC)=C1)Cl)C(O)=O
MCULE-8138019658 0.65 C1(=CC(O)=CC=C1Br)C(OC)=O
MCULE-4936094706 0.65 Cl.C(O)(=O)C1=CC=CC(OCCN)=C1
MCULE-2041964260 0.65 C12C(C=CC(C=O)=C1O)=CC1C(=CC=CC=1)C=2
MCULE-8315560029 0.65 C(=O)(C1=CC=C(C)C(O)=C1)C
MCULE-7769800711 0.65 C(OC)(=O)C1=CC=C(O)C=C1C(OC)=O
MCULE-1044438929 0.65 COC1C=CC(C(=O)O)=C(C(=O)O)C=1
MCULE-4192153951 0.65 C1(C(O)=O)=C(O)C=C2C(C=C(C=C2)Br)=C1
MCULE-2637422866 0.65 O=C(C1=CC2C(=C(OC(F)(F)F)C=CC=2)C=C1)O
MCULE-7460030431 0.65 O=C(C1=CC2C(=CC=C(OC(F)(F)F)C=2)C=C1)O
MCULE-3186524761 0.65 C1(OC2C=CC=CC=2)=CC=CC(=C1)C(=O)OC
MCULE-8495609190 0.65 COC(C1C=C(OC)C=C(CO)C=1)=O
MCULE-4550957009 0.65 O=C(O)C1C=CC=C(C2C=C(O)C=CC=2)C=1
MCULE-3906021958 0.65 O=CC1C=CC=C(CO)C=1
MCULE-2706678981 0.65 C(O)(=O)C1C=CC(=CC=1)OC(C)C
MCULE-8475535962 0.65 O=CC1=CC=CC(=C1)OCC1C=CC=CC=1
MCULE-3612116552 0.65 C12C=CC=CC=1C=CC(OC)=C2C(=O)O
MCULE-9438794539 0.65 C(OC)(=O)C1=CC(OC)=CC(C=O)=C1
MCULE-5186347408 0.65 C1(OC)C(OC)=CC(C(O)=O)=CC=1O
MCULE-3548058100 0.65 C(OC)(=O)C1=CC=CC(O)=C1F
MCULE-5099340281 0.65 C1(C(O)=O)C(OC)=CC2C(=CC=CC=2)C=1
MCULE-3395037903 0.65 C12C=CC=CC1=CC=C(C=O)C=2O
MCULE-7251691797 0.65 COC(C1C=C(O)C=CC=1Cl)=O
MCULE-4805269713 0.65 C(=O)(O)C1C=C2C(=CC=1)C=C(C=C2)OC(C)=O
MCULE-1703228442 0.65 C1(CO)=CC(C=O)=CC(OC)=C1O
MCULE-4077876402 0.65 C12C=CC=CC1=C(O)C=CC=2C=O
MCULE-6235547307 0.65 O=C(C1C=CC(O)=CC=1)OC(C)(C)C
MCULE-5359443057 0.65 C1=C2C(C=CC=C2)=CC(O)=C1C=O
MCULE-5958468626 0.65 C(O)(=O)C1=CC=C(C=C1)COC1=CC=CC(=C1)C=O
MCULE-2049165601 0.65 C1(C(=CC=CC=1C(C)C)O)C(O)=O
MCULE-8180253283 0.65 OC(C1=C(Cl)C(Cl)=CC(O)=C1)=O
MCULE-7982951852 0.65 C1(C=O)C(O)=CC=C2C=CC=CC=12
MCULE-6927120476 0.65 C(OC)(=O)C1C=CC=C(C=1)OCC1C=CC=CC=1
MCULE-8249773134 0.65 C1(C2=CC=CC(O)=C2)=CC=C(C(OC)=O)C=C1
MCULE-5618565310 0.65 C1(=CC(=CC=C1I)O)C(=O)OC
MCULE-7256555418 0.65 [O-]C1C=CC(C(=O)OCC)=CC=1.[Na+]
MCULE-1941902518 0.65 COC1=C(OC)C=C(C(O)=O)C(C)=C1
MolPort-001-732-377 0.64 C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)NC(CS)C(O)=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4
MolPort-001-732-341 0.64 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-2756789462 0.64 C(OC)(=O)C1=CC=C(C(C)=C1)O
MCULE-3489715634 0.64 C12C=CC=CC1=CC=CC=2COC1=CC=CC(C=O)=C1
MCULE-8895412662 0.64 C1=CC(O)=C(C)C(C(OCC)=O)=C1O
MCULE-5436739556 0.64 COC(C1=CC(Br)=CC(O)=C1)=O
MCULE-5764544867 0.64 C(O)(=O)C1C=CC=C(C=1)OC1=CC=CC=C1OC
MCULE-3956627299 0.64 C1=CC(OC)=C(C)C(C(O)=O)=C1OC
MCULE-2907343177 0.64 C1(C(O)=O)=C(O)C=C(C(C(O)=O)=C1)C(O)=O
MCULE-7172026921 0.64 C1(=CC(O)=CC(N)=C1)C(OC)=O
MCULE-3307978532 0.64 O=CC1C=CC=C(C=1)OCC1C=CC(=CC=1)C
MCULE-6062708893 0.64 O=C(C1C=C(OC)C=C(C(=O)OC)C=1)O
MCULE-3505719570 0.64 C1(=CC=CC(OC)=C1N)C(O)=O
MCULE-9812228835 0.64 OC1C(O)=C(C)C(C(=O)OCC)=CC=1
MCULE-8160479288 0.64 O=C(O)C1C=CC(C2C(O)=CC=CC=2)=CC=1
MCULE-4730494546 0.64 C1(CO)=C(C)C=C(C=C1C)O
MCULE-7764530900 0.64 C(OC)(=O)C1=CC=C(C=C1)OC
MCULE-4795775601 0.64 C(O)(=O)C1C=CC=CC=1CO
MCULE-6611632146 0.64 C1(=C(C=CC=C1C(OC)=O)O)C(OC)=O
MCULE-3681534655 0.64 C(OC)(C1C=CC=CC=1)=O
MCULE-4548499262 0.64 C(O)(=O)C1C=CC(=C(OC)C=1)Br
MCULE-1791733091 0.64 C1(C(O)=O)C(O)=CC(=C(C(O)=O)C=1)O
MCULE-9633722102 0.64 C1(C=C(OC)C=CC=1C)C(OC)=O
MCULE-7985432575 0.64 CC1=CC2=C(C(=C(C=C2)C)C(O)=O)C=C1
MCULE-8516205664 0.64 COCC1=C(OC)C=C(C(O)=O)C=C1
MCULE-6272883885 0.64 C(OC)(=O)C1=CC(O)=CC(F)=C1
MCULE-6070464733 0.64 OCC1=C(O)C=CC=C1
MCULE-4618120228 0.64 C(OCC)(=O)C1C=CC2=CC(OC)=CC=C2C=1
MCULE-7074931025 0.64 C(OC)(=O)C1=CC=C(CO)C(OC)=C1
MCULE-7642820980 0.64 C(O)(=O)C1=CC=CC=C1C=O
MCULE-9673318529 0.64 C1(C=O)=CC=C(C)C(=C1)OC
MCULE-1088219677 0.64 C1(C=O)=CC(C=O)=CC(O)=C1O
MCULE-1116314925 0.64 C1=C(C(O)=O)C=C(C)C=C1C(O)=O
MCULE-2710147534 0.64 C12C(=CC=CC=1C(O)=O)C=CC=C2C(O)=O
MCULE-5398143708 0.64 OC1C(O)=CC(C=O)=C(O)C=1
MCULE-4638289086 0.64 C1(=CC=C2C(C=C(C=C2)F)=C1O)C(O)=O
MCULE-1202172106 0.64 OC1=CC(C(OCC2=CC=C(Br)C=C2)=O)=CC=C1
MCULE-9599926365 0.64 NC(C1=CC(O)=CC=C1)=O
MCULE-5665550682 0.64 O=C(C1C(C)=CC(OCC)=CC=1)O
MCULE-5098628604 0.64 C1(CN)C=C(C=C(O)C=1O)C(O)=O
MCULE-4915797497 0.64 O=C(C1C(C)=CC(O)=CC=1)OCC
MCULE-5521177928 0.64 O=C(C1C(C(=O)OC)=CC(O)=C(O)C=1)OC
MCULE-9155855646 0.64 C1(=CC=C2C(C=C(C=C2)Cl)=C1O)C(O)=O
MCULE-2481502954 0.64 C(O)(=O)C1C=CC=C(C=1)C(O)=O
MCULE-4110698487 0.64 O=C(C1C=CC(OC2C=CC(C)=CC=2)=CC=1)O
MCULE-2119077232 0.64 C(=O)(OCC1C=CC(=CC=1)C(OC)=O)C1C=CC=C(OC)C=1
MCULE-5762986194 0.64 C(O)(=O)C1C=CC(=CC=1)OC1=CC(C)=CC(C)=C1
MCULE-3705156077 0.64 C1(C=CC=C(OC)C=1C)C(OC)=O
MCULE-3338722082 0.64 C1(C(=O)OCC)=CC=CC(OCC)=C1
MCULE-2003601766 0.64 C1(C=CC=C(C)C=1O)C(OC)=O
MCULE-9499442840 0.64 C1(O)=C(C(OC)=O)C(C)=CC(C)=C1
MCULE-2613394585 0.64 COC(C1=C(O)C(OC)=CC=C1)=O
MCULE-3043599422 0.64 COC(C1=C(O)C=CC(OC)=C1)=O
MCULE-6363149413 0.64 CC1=CC(COC2=CC(C(O)=O)=CC=C2)=CC=C1
MCULE-2935055614 0.64 C1(OC)=CC=C(N)C(=C1)C(=O)O
MCULE-8111446819 0.64 OC(COC1=CC(C(O)=O)=CC=C1)=O
MCULE-9013764014 0.64 OC(C1=CC=C(OC2=CC=CC=C2)C=C1)=O
MCULE-4696992338 0.64 C1=CC=CC(=C1C(=O)OCC)O
MCULE-8377025602 0.64 C1=C(CO)C=CC(O)=C1
MCULE-8456469387 0.64 CCOC1=C(OC)C=C(C(O)=O)C=C1
MCULE-2385494637 0.64 C(O)(=O)C1C=CC=C(OCCC(C)C)C=1
MCULE-5067471347 0.64 C(OC)(=O)C1=CC=CC(=C1)OCC1C=CC=C2C=CC=CC=12
MCULE-4717278357 0.64 COC(C1=CC(OCC2=CC=C(C)C=C2)=CC=C1)=O
MCULE-1849436114 0.64 C1(=CC(=CC(C(OC)=O)=C1)OC)C(OC)=O
MCULE-8893871849 0.64 O=C(C1C=C(C)C(O)=C(C)C=1)OC
MCULE-3480462334 0.64 C(O)(=O)C1=CC=C(C=C1)OC1C=CC(=C(C)C=1)C
MCULE-5977301440 0.64 C1(CO)=CC(=CC(OC)=C1O)C(O)=O
MCULE-3251216039 0.64 O=CC1C=CC=C(OCC)C=1
MCULE-4509330001 0.64 C1(OC)C(OC)=CC(=CC=1OC)C(O)=O
MCULE-1520461261 0.64 O(C)C1=CC(C(=O)OC)=CC=C1C=O
MCULE-9413327752 0.64 C1(C(=O)O)C=C(OCCC)C=CC=1O
MCULE-6854677702 0.64 C1(=CC(CO)=CC(OC)=C1O)C(O)=O
MCULE-1582842093 0.64 O=C(C1C=C(O)C(I)=C(O)C=1)OC
MCULE-2769836529 0.64 C1(C=O)=CC(CO)=C(C=C1O)O
MCULE-2693876364 0.64 C1(O)C(O)=CC(=CC=1O)C(OCCC)=O
MCULE-8417027292 0.64 C1(O)C(=C(O)C=CC=1C(O)=O)C(O)=O
MCULE-5293633377 0.64 C(O)(=O)C1=CC=C(C=C1)OC1=CC=C(C=C1)C(O)=O
MCULE-2209987944 0.64 C(O)(=O)C1C=CC=C(OCCCC)C=1
MCULE-9127964859 0.64 COCCCOC1=CC(C(O)=O)=CC=C1
MCULE-5419935191 0.64 CCCOC(C1=C(O)C(O)=CC=C1)=O
MCULE-2950037574 0.64 C12=CC=C(C=C1C=CC(OC)=C2C)C(OC)=O
MCULE-7845313163 0.64 C1(=CC(O)=CC(O)=C1)C(C)=O
MCULE-8703793231 0.64 O=C(C1C=C(O)C(Br)=C(O)C=1)OC
MCULE-9508211775 0.64 C1C(C(=O)O)=CC(C(=O)O)=CC=1C(=O)O
MCULE-1838547381 0.64 C1(=CC=C2C(C=C(C=C2)Br)=C1O)C(O)=O
MCULE-6551555469 0.64 C1(C=C(OCC)C=CC=1OC)C(O)=O
MCULE-4841633599 0.64 C1(C=CC(=CC=1O)N)C(O)=O
MCULE-7747934587 0.64 C1(C=C(C)C=C(OCC2C=CC=CC=2)C=1)C(O)=O
MCULE-9056096119 0.63 C1(=C(C=CC=C1C=O)OC)C(O)=O
MCULE-7910702293 0.63 C(O)(=O)C1=CC=CC(OCCOCC)=C1
MCULE-1359909539 0.63 C1=C(Br)C(=C(C=C1C(O)=O)Br)O
MCULE-4637829217 0.63 C(OCC)(=O)C1=CC=CC(OC(C)C)=C1
MCULE-9183740531 0.63 C(OC)(=O)C1=CC(OC)=C(C)C(O)=C1
MCULE-8628225137 0.63 COC1=C(F)C(C(O)=O)=CC=C1
MCULE-8938578055 0.63 C1(=O)C2=C(C=C(O)C=C2)CO1
MCULE-9821428758 0.63 C1C=C(C(=O)O)C(Cl)=C(OC)C=1
MCULE-9419567098 0.63 C(O)(=O)C1=CC=CC(OC)=C1C(O)=O
MCULE-6027726310 0.63 C1(C(=O)OCC)C(C)=CC(O)=CC=1C
MCULE-1208568166 0.63 C1(C=C(OC)C(C(C)(C)C)=CC=1)C(O)=O
MCULE-8909762659 0.63 C1(C(OC)=O)=C(O)C2=CC=CC=C2C=C1C(OC)=O
MCULE-3654038158 0.63 O=C(C1C=C(OC(F)F)C=C(C)C=1)O
MCULE-8512639518 0.63 O=CC1C(O)=CC=CC=1O
MCULE-7351327486 0.63 C1(O)=C(C)C=CC=C1C=O
MolPort-001-732-390 0.63 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-335 0.63 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(CC(O)=O)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-346 0.63 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-001-732-371 0.63 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)ON3C(=O)CCC3=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-1013344266 0.63 C(OCC)(=O)C1C=CC(=C(O)C=1)Cl
MCULE-5020839537 0.63 C1(OC2=CC=C(C)C=C2)=CC=CC(C(OC)=O)=C1
MCULE-9376572647 0.63 C1(=CC(C)=CC(OCC=C)=C1)C(O)=O
MCULE-9090827861 0.63 C1=C2C(C(C)=CC=C2OC)=C(O)C=C1C(OCC)=O
MCULE-9959004530 0.63 C(O)(=O)C1=C(C)C=CC(N)=C1O
MCULE-8505512736 0.63 C1(C=C(OC)C=CC=1F)C(O)=O
MCULE-5864210378 0.63 C1(C=C(OCC(C)C)C=C(OC(C)C)C=1)C(O)=O
MCULE-1959640910 0.63 C1(OC)C=C(C=CC=1C(C)C)C(O)=O
MCULE-7885066375 0.63 COC1C=CC(C(=O)O)=C(C)C=1OC
MCULE-9150292285 0.63 CC1=C(O)C=C(C(OCC2=CC=C(C#N)C=C2)=O)C=C1
MCULE-7466225358 0.63 C(O)(=O)C1=CC=C(C(OC)=C1)I
MCULE-4508701155 0.63 C1(=C(C)C=CC(C(C)C)=C1O)C(O)=O
MCULE-6177707042 0.63 [Na+].C1(OC)=C(OC)C=C(C=C1OC)C(=O)[O-]
MCULE-2711061517 0.63 C1(C=C(OC)C=C(OC)C=1)C(OCC)=O
MCULE-2078176512 0.63 C(OC)(=O)C1=CC=C(O)C(C)=C1C
MCULE-2660788689 0.63 C1(=CC=CC(OC)=C1Br)C(O)=O
MCULE-7496539145 0.63 C12C=CC=CC1=C(Br)C(O)=C(C(=O)O)C=2
MCULE-1977254783 0.63 C(O)(=O)C1C=CC=C(C=1)OCC1=CC=CC=C1C
MCULE-9820315195 0.63 C(OC)(=O)C1=CC(C)=C(O)C=C1C
MCULE-6817817500 0.63 CCOC1=C(OC)C=CC(C(O)=O)=C1
MCULE-8848638670 0.63 IC1=C(C=C(C)C(C(=O)O)=C1)O
MCULE-1053926987 0.63 C1(C=C(OC)C=CC=1I)C(O)=O
MCULE-7469307533 0.63 COC1=CC(CO)=CC=C1
MCULE-7424608363 0.63 C(O)(C1C=CC=C(OCC2CC2)C=1)=O
MCULE-6518252552 0.63 COC1=CC(C(O)=O)=C(Br)C=C1
MCULE-8580211640 0.63 C(O)(=O)C1=CC=C(C(OCC)=C1)OCC
MCULE-4490828035 0.63 O=C(C1C=C(O)C(I)=CC=1)OCC
MCULE-2262622690 0.63 C(O)(=O)C1C=CC(=C(OC)C=1)F
MCULE-7730980521 0.63 C1(C=C(OC)C=CC=1Cl)C(O)=O
MCULE-5285830146 0.63 COC(C1=CC(OC)=C(OC)C=C1)=O
MCULE-7765627778 0.63 C1(C(O)=O)C=C(Br)C2=C(C=CC=C2)C=1O
MCULE-2762792150 0.63 [Na+].O=C(C1C(O)=CC=C(Br)C=1)[O-]
MCULE-4665844704 0.63 COC(C1C(OC)=CC=C(O)C=1)=O
MCULE-2608114207 0.63 C1(C(O)=CC=C(O)C=1C(OC)=O)C(OC)=O
MCULE-1392815311 0.63 C1=C(O)C=C(C=C1)C(=O)OC1C=CC(C=O)=CC=1
MCULE-2919198400 0.63 O=C(C1C=C2C(C=C(C=C2)N(C)C)=C(O)C=1)OC
MCULE-7251515826 0.63 C(OCC)(=O)C1C=CC(=C(OC)C=1)C
MCULE-3391910926 0.63 C1(C(O)=O)=C(C)C=C(C=C1C)OCC
MCULE-3232075037 0.63 C(O)(=O)C1C=CC(=C(OC)C=1)OC(C)C
MCULE-6777771468 0.63 O=C(C1C=C(O)C(OC(F)F)=CC=1)O
MCULE-6819997607 0.63 C1=C(C(O)CC)C=C(C(=C1)C(=O)O)O
MCULE-4370137677 0.63 C(O)(=O)C1=CC(OC(F)(F)F)=CC(C)=C1
MCULE-8720531816 0.63 C(OCC(Cl)(Cl)Cl)(=O)C1=CC(O)=CC(O)=C1
MCULE-7518874576 0.63 O=C(C1C=C(OCC)C=C(O)C=1)OC
MCULE-8364642061 0.63 O=CC1C(N)=CC=C(O)C=1
MCULE-7524524241 0.63 C(O)(C1=C(C)C=CC(=C1O)C(C)(C)C)=O
MCULE-6812636215 0.63 COC1=CC(C(OC2=CC=CC=C2)=O)=CC=C1
MCULE-1930030882 0.63 O=C(C1C=C(Cl)C=C(O)C=1)OC
MCULE-9419236554 0.63 OC(C1C=CC(OCC2C=CC=CC=2)=C(O)C=1)=O
MCULE-8483297197 0.63 C1(C(=O)O)=C(C)C=C(C)C(O)=C1Br
MCULE-6158958624 0.63 C1(C=O)C=C(COC)C=CC=1O
MCULE-3230595907 0.63 C(O)(=O)C1C=CC(=C(OCCC)C=1)C
MCULE-8952898221 0.63 COC1C(I)=C(C(=O)O)C=CC=1
MCULE-5269450348 0.63 C(O)(=O)C1C=CC(=C(OCC(C)C)C=1)C
MCULE-7919021354 0.63 O=C(C1C=C(O)C(Br)=CC=1)OCC
MCULE-4429985062 0.63 COC1C=C(C)C=C(C=O)C=1
MCULE-4249699976 0.63 O=CC1C(N)=C(O)C=CC=1
MCULE-8706174451 0.63 OC1=CC(C(OCC2=CC(Br)=CC=C2)=O)=CC=C1
MCULE-3427428269 0.63 O1C(=O)C2C(=CC(=CC=2)O)C1=O
MCULE-5790378139 0.63 C(O)(=O)C1C=CC(Cl)=C(OC)C=1
MCULE-2757912540 0.63 C(O)(=O)C1=CC(Br)=C(C)C=C1O
MCULE-1050164158 0.63 C(OC)(=O)C1=CC=C(C(C)=O)C=C1O
MCULE-9464029408 0.63 C(O)(=O)C1=CC=CC(OC2CCC2)=C1
MCULE-4494886102 0.62 CC1C(C(OC)=O)=CC(O)=C(OC)C=1
MCULE-5070568078 0.62 C12C=C3OCOC3=CC1=C(C=C(C(O)=O)C=2)O
MCULE-4004788239 0.62 C1C(=CC=CC=1O)COCC
MCULE-3883732360 0.62 C1(C(O)=O)=C(O)C=C(C(Cl)=C1)C
MCULE-7795881759 0.62 C1(C=C(COC)C=CC=1O)C(O)=O
MCULE-8164937861 0.62 C1(COC)C=C(C=CC=1O)C=O
MCULE-2863025908 0.62 C12C(=CC=CC=1C(OC)=O)C=CC1=CC=CC=C21
MCULE-9785784011 0.62 COC(C1C=C2C=CC3C=CC=CC=3C2=CC=1)=O
MCULE-7346305541 0.62 C12=C(C=CC=C1C(OC)=CC(C(O)=O)=C2)Cl
MCULE-6601415873 0.62 C12=C(C=CC=C1C(OC)=CC(C(O)=O)=C2)F
MCULE-4622944403 0.62 O=C(C1C(C)=CC(O)=CC=1C)OC(C)(C)C
MCULE-8081183602 0.62 CCC1C(O)=CC=CC=1C(OC)=O
MCULE-2599776639 0.62 O=C(C1C=C(I)C=C(OC)C=1)O
MCULE-7677978676 0.62 O=C(C1C(F)=C(O)C=CC=1F)OC
MCULE-1296667282 0.62 O=CC1C=C(OC(C)(C)C)C=CC=1
MCULE-2536122223 0.62 O=C(C1C=C(N)C=C(OC)C=1)O
MCULE-1095639146 0.62 O=C(C1C(N)=CC(O)=CC=1)O
MCULE-3934837125 0.62 C1(C=CC=CC=1C1=CC=CC(O)=C1)C(O)=O
MCULE-8381822150 0.62 C(OC(C)C)(=O)C1=CC=CC=C1O
MCULE-9997520878 0.62 C1(C(=O)OC)C=C(C(O)=C(OC)C=1)O
MCULE-6606363347 0.62 C12C(=CC=CC1=CC(OC)=CC=2)C=O
MCULE-9993524862 0.62 C(O)(=O)C1=CC(C)=C(C)C(C)=C1
MCULE-6811938154 0.62 C(=O)C1=CC=C(O)C(C)=C1
MCULE-1142134021 0.62 C1=C(C=C(C=C1)OC1C=CC(C=O)=CC=1)C(OC)=O
MCULE-2450353864 0.62 C1(C=CC(=C(C)C=1OC)C)C(O)=O
MCULE-4450280916 0.62 C(OCC)(=O)C1=CC=CC(=C1)OCC1=CC=CC=C1
MCULE-8279682606 0.62 C12=CC=C3C4C(C=CC(=CC=C1C(OC)=O)C2=4)=CC=C3
MCULE-7058207448 0.62 C1(=C(C)C=CC(C)=C1C)C(O)=O
MCULE-5367185557 0.62 C12C(C=CC3C=CC=CC1=3)=CC=C(C(OC)=O)C=2
MCULE-9253447376 0.62 C(O)(=O)C1=CC=CC(OC(=O)CC)=C1
MCULE-3002838874 0.62 C1(C=O)=CC(COC)=C(C=C1O)C
MCULE-4324188355 0.62 C1(OC)C=C(CO)C=C2C=CC=CC=12
MCULE-9657156147 0.62 C1(CO)C=C(C=C(O)C=1O)C(N)=O
MCULE-2829493173 0.62 COC1=C(OC)C=C(C(O)=O)C(C(O)=O)=C1
MCULE-6887484868 0.62 O(CC)C1=CC(C(=O)OC)=CC(=C1)OCC
MCULE-2225652504 0.62 O=C1C2C3C(C=CC=2)=CC=CC=3O1
MCULE-9887064262 0.62 CC1=C(C(O)=O)C(O)=C(Cl)C=C1
MCULE-7714204012 0.62 O=C(C1C=C(OC2C=CC=CC=2)C=CC=1)OCC
MCULE-2120637431 0.62 C12=CC(OC)=CC=C1C=CC(C=O)=C2
MCULE-9963320574 0.62 C(OCCOC(=O)C1C=CC(=C(O)C=1)O)(=O)C1=CC=C(C(O)=C1)O
MCULE-9523607649 0.62 COC(C1=CC2=C(C=CC=C2)C=C1)=O
MCULE-3185683902 0.62 CC1=C(O)C=C(C(N)=O)C=C1
MCULE-5200118171 0.62 CC(OC(C1=C(O)C=CC=C1)=O)(C)C
MCULE-8270839938 0.62 CC1=C(O)C=C(C(OCCCOC(C2=CC(O)=C(C)C=C2)=O)=O)C=C1
MCULE-5586094892 0.62 C1(=CC=CC2C=CC=CC1=2)C(OC)=O
MCULE-8313817847 0.62 C1(C([O-])=O)=CC=C(N)C=C1O.[K+]
MCULE-8721131371 0.62 CC1=CC(C)=C(C(O)=O)C(C)=C1
MCULE-9866304959 0.62 COC1=CC(COC(C2=CC=C(O)C=C2)=O)=CC=C1
MCULE-9687532784 0.62 CCOC(C1=C(O)C=C2C(C=CC=C2)=C1)=O
MCULE-3506346481 0.62 C(=O)(OCC1C=CC=CC=1)C1=CC(OC)=CC(OC)=C1
MCULE-1656925432 0.62 COC(C1=C(O)C=C(O)C=C1)=O
MCULE-7017864408 0.62 C(OC)(C1C=CC2=C(C=1)C=CC1=C2C2C(C=C1)=CC=CC=2)=O
MCULE-3087110023 0.62 C(O)(C1C(C)=CC(OC)=CC=1C(O)=O)=O
MCULE-8648903478 0.62 C1(C(=O)O)=CC=CC=C1O.C(CCCCCCCCN)CCCCCCCCC
MCULE-3363617443 0.62 C1(C=O)C=C(C)C=C(C)C=1O
MCULE-6988078499 0.62 C1(C(O)=O)C(C)=CC=C(Br)C=1O
MCULE-7858082469 0.62 C1C=CC=C2C(OC)=CC=C(C(=O)OC)C=12
MolPort-001-732-340 0.62 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccc(cc3)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-4089030681 0.62 COC(C1=CC(OC)=C(C)C(OC)=C1)=O
MolPort-001-732-352 0.62 COc1ccc(CNC(=O)CCC(=O)O[C@@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)C35OO4)cc1
MCULE-9306949535 0.62 C(O)(=O)C1C=CC2=C(C=CC(=C2)C(OC)=O)C=1
MolPort-001-732-378 0.62 C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)NCCc3ccc(O)c(O)c3)O[C@H]3OC4(C)CC[C@@H]1C23OO4
MCULE-2106318950 0.62 O=CC1=CC=CC(=C1)OCC1=CC=CC(C)=C1
MolPort-035-669-078 0.62 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)c(O)c3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-4152972626 0.62 C1(=CC(O)=CC=C1N(=O)=O)C(O)=O
MolPort-001-732-333 0.62 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccncc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-5963970082 0.62 C(O)(=O)C1C=CC(=C(N)C=1)O
MolPort-035-669-078 0.62 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)c(O)c3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-1885016168 0.62 C1(C=C(C)C=CC=1C)C(O)=O
MolPort-001-732-351 0.62 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)c(O)c3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MCULE-4027626493 0.62 C(O)(=O)C1=CC=CC(OCCOCCOCCOC2=CC=CC(C(O)=O)=C2)=C1
MCULE-4839408616 0.62 C(O)(=O)C1=CC=CC(OCCOCCOCCOCCOC2=CC=CC(C(O)=O)=C2)=C1
MCULE-8321863574 0.62 O=C(C1=CC2C(=CC(OC(F)(F)F)=CC=2)C=C1)O
MCULE-1098895004 0.62 C(O)(=O)C1C=CC(=C(C)C=1)C
MCULE-6680648385 0.62 C1(C)=C(OC)C(C)=C(C)C(C(O)=O)=C1
MCULE-6377289748 0.62 C1(C=CC(=CC=1C)C)C(O)=O
MCULE-5337091592 0.62 COC1=C(C)C=C(C(O)=O)C=C1C
MCULE-7182843680 0.62 OC(C1=C(O)C=CC(OCC2=CC=CC=C2)=C1)=O
MCULE-8906137113 0.62 CCC1=C(O)C(C(O)=O)=CC=C1
MCULE-7086926400 0.62 C1(=CC=CC(C(C)C)=C1O)C(O)=O
MCULE-5793867192 0.62 C1(=CC(OCC2C=CC=CC=2)=CC(OCC2C=CC=CC=2)=C1)C(O)=O
MCULE-6280505644 0.62 C1=C2C=CC(C(=O)OC)=CC2=CC=C1C(=O)OC
MCULE-6566886673 0.62 C1(=CC=C(OC)C(OC)=C1O)C(O)=O
MCULE-8757876813 0.62 OC(C1=CC=C(COC2=CC=CC=C2)C=C1)=O
MCULE-9277488598 0.62 C1(I)=CC(C(=O)O)=C(O)C=C1
MCULE-2861972161 0.62 C1=CC(=CC(Br)=C1C(=O)O)O
MCULE-1434337294 0.62 COC(C1=C(O)C=CC(C)=C1)=O
MCULE-2357620865 0.62 C(O)(=O)C1=CC=C(C=C1)C1C=CC=C(OC)C=1
MCULE-6276948791 0.62 C(OCC)(=O)C1=CC=C(C(OC)=C1)O
MCULE-4542772337 0.62 C1(C(OC)=O)C(O)=CC(=CC=1O)O
MCULE-9876642365 0.62 C(O)(=O)C1=CC=C(C(C)=C1)OC
MCULE-1899116810 0.62 C1C=C(C(=C(C=1)O)N(=O)=O)C(=O)O
MCULE-1474817814 0.62 C(OC)(C1=C2C=CC=CC2=CC2C=CC=CC=21)=O
MCULE-2746074430 0.62 C1(C(=CC=CC=1F)O)C(O)=O
MCULE-3715379501 0.62 C1(C=CC(F)=CC=1O)C(O)=O
MCULE-3687405327 0.62 C1C2C(=C(Br)C(O)=C(C(O)=O)C=2)C=CC=1Br
MCULE-7118087142 0.62 C1=CC(C(=O)O)=C(F)C=C1O
MCULE-1612767952 0.62 C1=CC=C(OC)C(=C1O)C(=O)O
MCULE-6780862976 0.62 C(=O)(C1C=CC=C(OC)C=1)OC1C=CC=C2C=CC=CC=12
MCULE-1359939534 0.62 C1(=C(C=CC=C1N)O)C(O)=O
MCULE-7317874813 0.62 C1=C(O)C=C(C(=C1O)C(=O)OC)C
MCULE-2080421419 0.62 C1(C=CC(=CC=1O)N)C(=O)[O-].[Na+]
MCULE-5288561358 0.62 O=CC1C=CC=C(C=1)OCC1=CC=C(C=C1)OC
MCULE-3129607155 0.62 C1(C(O)=O)C(O)=C(C)C=CC=1C(C)C
MCULE-8711124969 0.62 C1(C(OC)=O)=CC2C=CC3=C(C=CC=C3)C=2C2C=CC3C=CC=CC=3C1=2
MCULE-7215377595 0.62 C12=C3C=CC=CC3=CC=C1C(=CC1=CC=C(C)C=C21)C(OC)=O
MCULE-9247864478 0.62 C1(=CC=CC(C)=C1C)C(O)=O
MCULE-1322831364 0.62 C1(F)=C(C(=O)O)C(F)=C(O)C=C1F
MCULE-2477442780 0.62 OC1=C(C(OCC2=CC=CC=C2)=O)C=CC=C1
MCULE-2999240649 0.62 O=C(C1C(C(F)(F)F)=CC=CC=1O)O
MCULE-2467650049 0.62 C(O)(=O)C1C=CC(=C(I)C=1)O
MCULE-5299269657 0.62 COC1C=C(C(=O)O)C=CC=1C#N
MCULE-4883893684 0.62 C1(O)C(C)=CC(=CC=1C)C=O
MCULE-5752745805 0.62 C1(=CC(=CC=C1O)N)C(O)=O
MCULE-8194822619 0.62 C1(C=C(O)C=CC=1C(O)=O)C(F)(F)F
MCULE-2744918163 0.62 C1(C(OC)=CC=C(C=1)C(O)=O)OC(C)C
MCULE-9093077710 0.62 C(O)(=O)C1=CC=C(C(OCC)=C1)OC(C)C
MCULE-6612875777 0.62 O=CC1C=CC(=CC=1)OCC1C=CC=C(OC)C=1
MCULE-2518473417 0.62 C1=CC(=C2C=C(O)C(C(=O)OC)=CC2=C1)OC
MCULE-8637110992 0.62 C1(C(=C(C(=O)O)C(C)=C(C=1)C)C)C
MCULE-8294145883 0.62 C(=O)(C1C=CC=C(OC)C=1)OC1C=CC2C(=CC=CC=2)C=1
MCULE-1744813492 0.62 C(C(C)C)(=O)OC1=CC=CC(=C1)C(O)=O
MCULE-8178132024 0.62 C1(=CC(OC)=CC(F)=C1)C(O)=O
MCULE-4091475320 0.62 C1(C=CC=C(C)C=1OC)C(O)=O
MCULE-3930696324 0.62 C1(C=O)C=C(C)C=CC=1O
MCULE-8958629252 0.62 C1(C=CC(=CC=1C)OC)C(OC)=O
MCULE-6840935502 0.62 C1(=CC=CC(C=O)=C1O)C(OC)=O
MCULE-5170373868 0.62 C1(C)C(C)=C(OC)C=CC=1C(O)=O
MCULE-1707290022 0.62 C1C(OC)=C(C(O)=O)C(C)=CC=1C
MCULE-6722364950 0.62 C1(C=C(OC)C=C(Br)C=1)C(O)=O
MCULE-4392918752 0.62 C1(C=O)C(C)=CC(=CC=1O)O
MCULE-7649008147 0.62 CC(C1C=C(C(=O)O)C(C)=CC=1O)C
MCULE-6403076580 0.62 C1(=C(OCC)C=CC(=C1)C(O)=O)OC(C)C
MCULE-3041084301 0.62 C(O)(=O)C1C=CC=C(C=1)OCC(C)=C
MCULE-1378878669 0.62 C1(=CC=CC(N)=C1O)C(O)=O
MCULE-4322256720 0.62 C1(C)C=C(C(O)=O)C(C)=CC=1OC
MCULE-2597165664 0.62 C1(C=O)=CC=CC(C=O)=C1O
MCULE-5608500124 0.62 C1C(O)=C(C(OCC)=O)C(C)=CC=1
MCULE-4747891013 0.62 C1(=CC=CC=C1C(O)=O)C(O)=O
MCULE-9763035547 0.62 C1(=CC=CC(=C1)C=O)OC(C)C
MCULE-1145871356 0.62 C(O)(=O)C1=CC=C(C=C1)COC
MCULE-2333222478 0.62 C(=O)(OC1=CC=CC=C1)C1=CC=CC(OCC)=C1
MCULE-5176134610 0.61 C1(C(C)=O)C(O)=CC(=C(O)C=1)CC
MCULE-7793323429 0.61 OC(C1=C(O)C=C(I)C=C1)=O
MCULE-7317280981 0.61 O=CC1C(F)=C(O)C=CC=1
MCULE-7605158487 0.61 C1(O)=C(CC)C=C(C(=O)O)C=C1
MCULE-7721368374 0.61 COC1C=C(Cl)C=C(C(=O)O)C=1
MCULE-3017030830 0.61 Cl.C(O)(=O)C1C=CC(=C(N)C=1)O
MCULE-2166658788 0.61 O=C(C1C=C(C(C)(C)C)C(O)=CC=1)O
MCULE-4931540537 0.61 O=CC1C=C(O)C=C(OC)C=1
MCULE-5401642453 0.61 C(N)(C1=CC(O)=CC(O)=C1)=O
MCULE-6039366976 0.61 C(O)(=O)C1=CC(OC)=C(N)C(OC)=C1
MCULE-6180130581 0.61 C12C(C(=O)O)=CC=C(C(O)=O)C=1C(C(=O)O)=CC=C2C(=O)O
MCULE-5931077004 0.61 C1(=CC=CC(C(=O)OC)=C1)OC(F)(F)F
MCULE-8350395001 0.61 O=C(C1=C(O)C=CC(OC(F)(F)F)=C1)O
MCULE-1440330485 0.61 C1(C=O)C(O)=CC=C(C=1)C(OC)=O
MCULE-1018404695 0.61 OC(C1=CC2=C(C=C(C=C2)C#N)C=C1)=O
MCULE-6292903963 0.61 C1(=CC=CC=C1C(O)=O)C(=O)[O-].[K+]
MCULE-5409210097 0.61 C1(C=O)C(OC)=C(O)C=CC=1C(O)=O
MCULE-1057826270 0.61 C1(Br)C(=CC=CC=1C=O)O
MCULE-2396661646 0.61 O=C(C1C(O)=C(F)C=CC=1)O
MCULE-2494381839 0.61 C1(C(O)=O)=CC(OC(C)=O)=C2C(C=CC=C2)=C1O
MCULE-4512469040 0.61 COC(C1=CC(OCC2=C(C)C=CC=C2)=CC=C1)=O
MCULE-3586715500 0.61 C(O)(C1=C(C2C=CC3C=CC=CC=3C=2C2C=CC=CC=21)C(O)=O)=O
MCULE-3993123795 0.61 C1(C=CC=C(C(OC)=O)C=1O)C(OC)=O
MCULE-7279140025 0.61 C(C)(C)(C)C1C=C(C=C(C)C=1O)C(O)=O
MCULE-4372772842 0.61 C(O)(C1=CC(C)=CC(=C1O)C(C)(C)C)=O
MCULE-6199100243 0.61 C1(O)C=C(C=CC=1I)C=O
MCULE-5128815244 0.61 O=C(O)C1C=C(O)C=C(C2C=C(OC)C=CC=2)C=1
MCULE-1012461720 0.61 C(O)(=O)C1=CC=C(C=C1)OC1C=CC(=CC=1)OC
MCULE-4658064312 0.61 O=C(C1C(C(=O)[O-])=CC=CC=1)[O-].[Na+].[Na+]
MCULE-1169614978 0.61 C12=C(C=CC3C=CC=C(C4=CC=CC=C4)C1=3)C=C(C1C=CC=CC2=1)C(O)=O
MCULE-5482825516 0.61 C(O)(=O)C1C=CC(=C(OCC)C=1)N
MCULE-9501549860 0.61 C1(=CC=C(O)C(O)=C1)C(C)=O
MCULE-3207489848 0.61 C1=CC(C(=O)OC)=CC(OCC#N)=C1
MCULE-4309665557 0.61 OC(C1=CC(OC2=CC=C(Cl)C=C2)=CC=C1)=O
MCULE-3783208976 0.61 C(OC)(=O)C1C=CC=C(OCCOC2C=CC=C(C=2)C=O)C=1
MCULE-1224126274 0.61 C1=C(Br)C(=CC(C=O)=C1)O
MCULE-1560043021 0.61 C(=O)C1=CC=C(C(C)C)C=C1O
MCULE-8304192607 0.61 C(=O)C1=CC=C(CC)C=C1O
MCULE-8162554029 0.61 [Na+].C([O-])(=O)C1=CC(N)=CC=C1O
MCULE-5746324224 0.61 C1=C(C=CC(O)=C1C(=O)O)OCC1C2=CC=CC=C2C=CC=1
MCULE-7273618685 0.61 C1(OC)C=C(C(=O)OC)C=C(OC)C=1O
MCULE-1653500254 0.61 C(OC)(=O)C1=CC=C(C=C1)C1C=CC(=CC=1)O
MCULE-1984566197 0.61 CC(=O)C1C(C)=C(O)C=CC=1
MCULE-1308586116 0.61 C1(C=C(Br)C=C(C)C=1O)C(O)=O
MCULE-6375905715 0.61 OC(C1=CC(OC(F)F)=CC(OC(F)F)=C1)=O
MCULE-8849419143 0.61 [Cl-].C1(C(O)=O)=CC=CC([NH3+])=C1O
MCULE-6541411901 0.61 C(O)(=O)C1=CC=C(C=C1)OC1=CC=C(C=C1)O
MCULE-2889092043 0.61 C1(Cl)=C(C=CC=C1C=O)O
MCULE-8092192955 0.61 O=C(C1C(C(=O)OCC)=CC(O)=CC=1)OCC
MCULE-2624001012 0.61 C1(C)=CC(O)=C(C(=C1C=O)O)C
MCULE-8509421576 0.61 COCC1=CC=C(C(OC)=O)C=C1
MCULE-4308754578 0.61 COC1=C(N)C(C(O)=O)=CC(C)=C1
MCULE-9309136316 0.61 C12C=C(C=CC=1C=CC(C(=O)OC)=C2)C(=O)OC
MCULE-4408592799 0.61 C1(C=C(F)C=CC=1O)C(O)=O
MCULE-9545536984 0.61 C(=O)C1=CC=C(F)C(O)=C1
MCULE-3733444619 0.61 C1=CC(O)=CC(Cl)=C1C(=O)O
MCULE-7141739959 0.61 C1(C=O)C=C(O)C=CC=1Cl
MCULE-2916837518 0.61 CCOC1=CC(C(O)=O)=C(N)C=C1
MCULE-1570151433 0.61 C1(C(=CC=CC=1Br)O)C(O)=O
MCULE-2315350697 0.61 C1(=CC(O)=CC(OCC2C=CC=CC=2)=C1)C(OC)=O
MCULE-8859921112 0.61 COC(C1=CC=C(CO)C=C1)=O
MCULE-3583556986 0.61 O=C(C1C=C(OCC2C=CC=CC=2)C(C)=CC=1)O
MCULE-1244396324 0.61 OC1C=CC(I)=C(C=O)C=1
MolPort-035-669-080 0.61 COc1ccc(cc1)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MolPort-035-669-077 0.61 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CCN(CC3)c3ccccc3F)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-035-669-073 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)c3cccnc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-001-732-338 0.61 CSCCC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O
MolPort-020-005-671 0.61 C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3OC[C@]4(C)C[C@@H]1[C@@]23OO4
MolPort-001-732-399 0.61 CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CS)C(O)=O
MolPort-000-814-000 0.61 CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CS)C(O)=O
MolPort-035-669-071 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)N3CCN(CC3)C(c3ccccc3)c3ccccc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-039-142-119 0.61 CC1CCC2C(C)C(O)OC3OCC4(C)CC1C23OO4
MolPort-035-669-071 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)N3CCN(CC3)C(c3ccccc3)c3ccccc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-001-732-375 0.61 COc1ccc(CCNC(=O)CCC(=O)O[C@@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)C35OO4)cc1
MolPort-035-669-087 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)NCc3ccc(CN4CCOCC4)cc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-001-732-365 0.61 C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccco3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4
MolPort-035-669-073 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)c3cccnc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-035-669-087 0.61 C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)NCc3ccc(CN4CCOCC4)cc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MolPort-020-005-671 0.61 C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3OC[C@]4(C)C[C@@H]1[C@@]23OO4
MolPort-039-142-119 0.61 CC1CCC2C(C)C(O)OC3OCC4(C)CC1C23OO4
MolPort-035-669-080 0.61 COc1ccc(cc1)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3
MolPort-035-669-077 0.61 C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CCN(CC3)c3ccccc3F)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4
MCULE-5270200564 0.61 C1C(C=O)=CC(O)=C(Cl)C=1
MCULE-9166382173 0.61 C1(=CC(O)=CC=C1O)C(C)=O
MCULE-4964515736 0.61 CC1=CC(C(O)=O)=C(O)C(Br)=C1
MCULE-9776459403 0.61 C1(=CC=C(C=C1O)Cl)C(O)=O
MCULE-5793827551 0.61 C(O)(=O)C1=CC=C(CBr)C(OC)=C1
MCULE-6148493460 0.61 CCC1=CC(C(O)=O)=C(O)C=C1
MCULE-8769074704 0.61 C1(C2C=CC=CC=2C=CC=1C(O)=O)C(O)=O
MCULE-5467497817 0.61 C12C=C(C(=O)O)C(C(=O)O)=CC1=CC=CC=2
MCULE-7831318043 0.61 COC1=CC(=CC(C(O)=O)=C1)C#N
MCULE-8318661261 0.61 OC(C1=C(Cl)C=CC=C1O)=O
MCULE-9295712354 0.61 C1(C=C(C=CC=1C(O)=O)OC(C)C)C(O)=O
MCULE-3306874171 0.61 OC(C1=CC(COC2=CC(C=O)=CC=C2)=CC=C1)=O
MCULE-6409935966 0.61 C1(=CC(OC)=CC(C=O)=C1)C=O
MCULE-6401762020 0.61 C(OC)(=O)C1=CC(C(F)(F)F)=CC(O)=C1
MCULE-1836581660 0.61 C1(C=O)C=C(O)C=CC=1Br
MCULE-7832010559 0.61 C1(C(OC)=O)=CC2=CC=CC=C2C(C=O)=C1O
MCULE-2627620953 0.61 C(=O)(C1=CC=CC(OC)=C1)OC1C=CC2C(=CC(=CC=2)OC(=O)C2=CC=CC(OC)=C2)C=1
MCULE-8437185561 0.61 C1(C(O)=O)C(O)=C(C=C(O)C=1Cl)Cl
MCULE-7646011311 0.61 C1(O)C=C(C=CC=1OC)C=O
MCULE-3358593263 0.61 C(=O)(OC1=CC=C(C=C1)OCC1C=CC=CC=1)C1C=CC=C(OC)C=1
MCULE-2500076923 0.61 C(=O)(OC1C=CC=C(C)C=1)C1=CC=CC(OC)=C1
MCULE-6661199693 0.61 C(OCCC)(=O)C1=CC=C(C=C1)O
MCULE-2997847622 0.61 C(C1=CC=CC(O)=C1O)(=O)C
MCULE-6169483466 0.61 C12C(O)=C(O)C=CC=1C=C(C=C(O)C2=O)C(OC)=O
MCULE-8328308256 0.61 C(=O)C1=CC(O)=CC=C1F
MCULE-6581419264 0.61 OC1=C(C(OCC2=CC=C(COC(C3=C(O)C=CC=C3)=O)C=C2)=O)C=CC=C1
MCULE-2028478324 0.61 OC1=CC(C(OCC2=C(Cl)C=CC=C2)=O)=CC=C1
MCULE-7860648493 0.61 C1C=C(OCCO)C(O)=C(C(O)=O)C=1
MCULE-3250951826 0.61 CC(OC(C1=C(O)C2=C(C=CC=C2)C=C1)=O)C
MCULE-9483235241 0.61 C(C1=CC=CC=C1)(=O)OC1=CC=CC(=C1)C=O
MCULE-1499870679 0.61 C(O)(=O)C1C=CC=C(OCCCCC)C=1
MCULE-6925491037 0.61 C1(=O)C2=C(C=CC=C2O)CO1
MCULE-5878221202 0.61 C(OC)(=O)C1C=CC=C(OCC=C)C=1
MCULE-7277542648 0.61 CCC[NH+](CC[NH+](CCC)CCC)CCC.OC1=C(C([O-])=O)C=CC=C1.OC1=C(C([O-])=O)C=CC=C1
MCULE-5362298046 0.61 C1(=CC=C2C(C(=CC=C2)Cl)=C1O)C(O)=O
MCULE-6427925183 0.61 C(O)(=O)C1=CC=CC(C(OC)=O)=C1O
MCULE-2726437098 0.61 C1(C=C(C=CC=1O)OCC1=CC=C(C=C1)C)C(O)=O
MCULE-8589093722 0.61 C(=O)(OC1C=CC=C(C=1)C(O)=O)C1C=CC=C2C=CC=CC=12
MCULE-1474534071 0.61 C1(C=C(C=CC=1O)OCC1C=CC2C(=CC=CC=2)C=1)C(O)=O
MCULE-1241836031 0.61 C(O)(=O)C1C=CC2C(=CC=C(N)C=2)C=1
MCULE-1908941662 0.61 NC(COC1=CC(C(O)=O)=CC=C1)=O
MCULE-1906477856 0.61 C(OCC)(=O)C1=CC=CC(=C1)OCC1C=CC(=CC=1)C
MCULE-4680545979 0.61 C(O)(=O)C1C=CC=C(OC2=CC=C(C=C2)F)C=1
MCULE-7590691375 0.61 C(OCC)(=O)C1=CC=CC(=C1)OCC1C=CC=C2C=CC=CC=12
MCULE-4078363527 0.61 COC(C1C=CC(OCC2C=CC=CC=2)=C(O)C=1)=O
MCULE-9366464435 0.61 C(O)(=O)C1C=CC=C(C2=CC=C(C=C2)O)C=1
MCULE-2821146441 0.61 OC1=CC=C(C(=O)O)C=C1C(C)C
MCULE-7055781331 0.61 C(OC)(=O)C1=CC=CC(OCCN)=C1
MCULE-4733693074 0.61 C(OC)(=O)C1C=CC(=CC=1)OCC
MCULE-5663481714 0.61 C1(=CC(C(OC)=O)=CC=C1)OCCBr
MCULE-2809709616 0.61 COC1=C(COC(C2=CC(O)=CC=C2)=O)C=CC=C1
MCULE-4793590646 0.61 COC(C1=CC(COC(C2=CC(OC)=CC=C2)=O)=CC=C1)=O
MCULE-2731026367 0.61 O=C(C1C(O)=C(Br)C=CC=1O)O
MCULE-4438549273 0.61 COC(C1=CC=C(C(OC)=O)C=C1)=O
MCULE-3083565333 0.61 CCOCCOC(C1=C(O)C=CC(O)=C1)=O
MCULE-4343023038 0.61 C1(C=O)=CC(=CC(C=O)=C1O)C(OC)=O
MCULE-6301039139 0.61 C12C(=CC=CC1=C(C=CC=2C(O)=O)C(O)=O)C(O)=O
MCULE-1035985854 0.61 OC(C1=CC(OCC(F)(F)F)=CC(O)=C1)=O
MCULE-9471061212 0.61 C1(C=O)=CC(C=O)=C(C=C1O)C
MCULE-1571887267 0.61 C1(=CC(OC(C)=O)=CC(OC(C)=O)=C1)C(O)=O
MCULE-3587806762 0.61 C(=O)(OC1C=CC(=CC=1)OC)C1C=CC=C(OC)C=1
MCULE-6278838119 0.61 C(C1=CC=CC=C1)(=O)OC1C=CC=C(C=1)C(OC)=O
MCULE-7471539927 0.61 C(O)(=O)C1C=CC=C(OC2C=CC(=CC=2)C#N)C=1
MCULE-3226693243 0.61 C1(C(O)=CC=C(C(C)(C)C)C=1)C(O)=O
MCULE-3367360630 0.61 C1(C=CC=C(Cl)C=1O)C(O)=O
MCULE-3412941779 0.61 C1(=CC(OC)=CC=C1C(C)(C)C)C(O)=O
MCULE-4335589438 0.61 C(=O)(OCC(C)C)C1C=CC(=CC=1)O
MCULE-9165969485 0.61 C(O)(=O)C1=CC=C(C=C1)OCC(C)(C)C
MCULE-1986250484 0.61 C1(=CC(Cl)=CC=C1O)C(O)=O
MCULE-5768623392 0.61 C1=C(OC(F)(F)F)C=CC(=C1C(=O)O)C
MCULE-2473954380 0.61 C1(I)=CC=CC(O)=C1C(O)=O
MCULE-6245529316 0.61 C1(O)=CC(I)=C(C(=O)O)C=C1
MCULE-3426927221 0.61 C(O)(=O)C1C=CC(=C(COC)C=1)O
MCULE-5488979007 0.61 CC(OC1=CC=C(C(O)=O)C=C1)=O
MCULE-5938392595 0.61 C(=O)(OCC1C=CC(=CC=1)C)C1=CC(OC)=CC(OC)=C1
MCULE-6448760622 0.61 C(OC)(=O)C1C=CC(=CC=1)C=O
MCULE-4590499575 0.61 C(OC)(=O)C1=CC=C(C=C1)C
MCULE-8423921578 0.61 C(=O)(OCC1C=CC=CC=1)C1=CC=CC(=C1)OCC1=CC=CC=C1
MCULE-5372933453 0.61 [O-]C(C1=CC=CC=C1C(=O)[O-])=O.[K+].[K+]
MCULE-6483439955 0.61 C(O)(=O)C1C=CC(=CC=1)OCC(C)C
MCULE-5632149961 0.61 C(=O)(OC1C=CC=C(C=1)C=O)C1C=CC=C(OC)C=1
MCULE-2142135975 0.61 C1(C(=CC=CC=1OC)OC)C(O)=O
MCULE-5721987194 0.61 C1(C=C(Br)C=C(Br)C=1O)C(O)=O
MCULE-7372919087 0.61 C1(C=CC(=CC=1O)OC)C(O)=O
MCULE-3172715227 0.61 C(O)(=O)C1=CC=C(C(F)=C1)O
MCULE-9027923684 0.61 CC(C1=CC(C(O)=O)=C(O)C=C1)C
MCULE-5923217877 0.61 C(O)(=O)C1C=CC(=CC=1)COC1C=CC2C(=CC=CC=2)C=1
MCULE-3183508337 0.61 CC1C(OC(F)F)=CC(C(O)=O)=CC=1
MCULE-9665473051 0.61 CCOC1=CC(C(O)=O)=C(OCC)C=C1
MCULE-5297384178 0.61 OC(C1=C(O)C=C(Br)C=C1)=O
MCULE-6106684483 0.61 C(=O)(OC1C=CC(=CC=1)OC(=O)C1=CC=CC(OC)=C1)C1=CC=CC(OC)=C1
MCULE-7799713489 0.61 COC(COC1=CC(C(O)=O)=CC=C1)=O
MCULE-6459563760 0.61 CC(C1=C(O)C=C(C)C=C1)=O
MCULE-8275803776 0.61 OCCOC1=CC=C(C(O)=O)C=C1
MCULE-5338433028 0.61 C1(C(OC)=O)=C(O)C=C(C2=CC=CC=C12)O
MCULE-8126141609 0.61 C(OC)(=O)C1=CC=CC(OCC#C)=C1
MCULE-6643526325 0.61 C/C(/C)=C/COC1=CC(C(O)=O)=CC=C1
MCULE-2317780312 0.61 OC(C1=CC(Cl)=C(O)C=C1)=O
MCULE-2397870856 0.61 C(O)(=O)C1C=CC(=CC=1)OCCC
MCULE-3269682275 0.61 C(O)(=O)C1=CC=C(C=C1)C(OC)=O
MCULE-6969600661 0.61 C1(C=C(OCC=C)C=C(OCC=C)C=1)C(O)=O
MCULE-9079615113 0.61 OC1=C(C(OCC2=C3C(C=CC=C3)=CC=C2)=O)C=CC=C1
MCULE-9405387369 0.61 C1(C=CC(=C(O)C=1)C=O)C(C)(C)C
MCULE-8107241908 0.61 COC1=CC(C(O)=O)=C(N)C(C)=C1
MCULE-9489353464 0.61 C1(OC(C)C)=CC(=CC(C(=O)OC)=C1)OC(C)C
MCULE-2229327611 0.61 O=C(C)C1=CC(O)=C(C)C=C1O
MCULE-6628442181 0.60 C1=CC(O)=C(C(=C1)CO)C(=O)OCC
MCULE-1385113526 0.60 C1(C=C(F)C=C(O)C=1N)C(O)=O
MCULE-8438275155 0.60 C1(CO)=C(O)C=CC(C(C)=O)=C1
MCULE-3614379483 0.60 C1C(OC)=CC(=CC=1OC)C=O
MCULE-5279293567 0.60 C(O)(=O)C1C=CC(=CC=1)C(C)(C)C
MCULE-4696124579 0.60 COC1C=C(C(=O)O)C=CC=1C(F)(F)F
MCULE-6466395396 0.60 C1(=CC(OCC2C=CC=CC=2)=CC(OCC2C=CC=CC=2)=C1)C(OC)=O
MCULE-5840394196 0.60 C(=O)(C1=CC=CC(OC)=C1)OC1=CC=CC2=C1C=CC=C2OC(=O)C1=CC=CC(OC)=C1
MCULE-4500405539 0.60 C(OC)(=O)C1=CC=C(C=C1)COC1C=CC2C(=CC=CC=2)C=1
MCULE-9553246416 0.60 C1(C=O)=CC(=CC=C1O)OCC1C=CC=CC=1
MCULE-7568211829 0.60 C1(C(OC)=O)C(Br)=C(O)C=C(O)C=1Br
MCULE-7917159836 0.60 C1(C=C(O)C=C(C)C=1CC(C)C)C(O)=O
MCULE-6667088387 0.60 C1(C=C(CO)C(C)=C(CO)C=1)C(O)=O
MCULE-4788203664 0.60 COC(C1C=C(O)C(C)=CC=1F)=O
MCULE-2073493711 0.60 O=C(C1C(F)=C(F)C(F)=C(O)C=1)O
MCULE-5124576115 0.60 C1=C(OC)C=C(C)C(C(OC)=O)=C1C
MCULE-7875065777 0.60 C1(CC)=CC=C(O)C=C1C=O
MCULE-9220342574 0.60 C(C1C=CC=CC=1)(=O)OC1C=CC=C(C)C=1
MCULE-8997428239 0.60 C(O)(=O)C1=CC=C(C=C1)CC
MCULE-4998886121 0.60 O=C(C1=C(O)C(OC(F)(F)F)=CC=C1)O
MCULE-8428889014 0.60 C1(=CC=CC=C1OCC)C(O)=O
MCULE-2906489988 0.60 O=CC1C=C(O)C(OCC2C=CC=CC=2)=CC=1
MCULE-2631637035 0.60 C(C1C=C(CO)C=CC=1O)(=O)C
MCULE-7655675146 0.60 C1(=O)C2C(=CC=CC=2C(=O)O1)O
MCULE-2395040782 0.60 C(OCCC1C=CC=CC=1)(=O)C1C=CC=C(O)C=1
MCULE-7620985235 0.60 [O-]C1C=CC(C(=O)OCCC)=CC=1.[Na+]
MCULE-1544394008 0.60 O=CC1=CC=C(C=C1)COC1C=CC=CC=1
MCULE-4049913305 0.60 O=C(C1=C(F)C=C(O)C=C1F)O
MCULE-1258731281 0.60 NC1C(O)=CC=C(Cl)C=1C(=O)O
MCULE-2937408971 0.60 C1(O)C(=CC=CC=1C=O)OC
MCULE-5203335465 0.60 C(OC)(=O)C1=CC(O)=C(OC)C(OC)=C1
MCULE-9700363099 0.60 CCOC1=C(N)C(C(O)=O)=CC=C1
MCULE-4456076462 0.60 OC(C1=CC=C(OC2CC2)C=C1)=O
MCULE-1461486723 0.60 C(OCC)(C1C=CC=CC=1)=O
MCULE-2816314019 0.60 C1(C=C(C)C=CC=1OC)C(O)=O
MolPort-000-803-468 0.60 C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)ON3C(=O)CCC3=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4
MCULE-7743652425 0.60 C1(=CC=C(C(O)=C1F)F)C(OC)=O
MCULE-9542125705 0.60 C(O)(=O)C1=CC=C(C=C1)OC(C)CC
MCULE-1326143866 0.60 OCC1=CC(C(O)=O)=C(C)C=C1
MCULE-7346179959 0.60 C(O)(=O)C1=CC=C(C=C1)C(C)C
MCULE-9214283986 0.60 Cl.COC1=C(N)C(C(O)=O)=CC(C)=C1
MCULE-6834043085 0.60 CC1=C(C(O)=O)C(O)=C(F)C=C1
MCULE-8626086916 0.60 C(=O)(C1C=CC(=CC=1)O)OC(C)CC
MCULE-9935816622 0.60 O=C(C1C(C)=CC=C(OC)C=1)OCC
MCULE-4734647623 0.60 C1(C=O)=CC(O)=CC=C1OC
MCULE-2269978301 0.60 C1(C(O)=O)=C(C)C=C(C=C1C)C(O)=O
MCULE-2530634149 0.60 OC(C1=CC(O)=C(NC#N)C=C1)=O
MCULE-8760789243 0.60 CCOC1=CC=C(N)C(C(O)=O)=C1.Cl
MCULE-7337278426 0.60 C(OCCO)(=O)C1C=CC(=CC=1)O
MCULE-1953566837 0.60 C(OC)(=O)C1=CC(C=O)=CC=C1O
MCULE-8883425674 0.60 C(=O)(OC1C=CC=C(C=1)C=O)C1=CC=CC2=CC=CC=C12
MCULE-9655543041 0.60 COC(C1=CC=C(C(OC)=O)C2=C1C=CC=C2)=O
MCULE-9724177367 0.60 C(O)(=O)C1=CC=C(C(O)(C)C)C=C1
MCULE-6928868572 0.60 C(O)(=O)C1C=CC(=CC=1)COC1=CC=C(C(C)=C1)C
MCULE-2826025526 0.60 CC(C1=CC(O)=C(O)C(C)=C1)=O
MCULE-9277774174 0.60 C1(=CC=CC(OC)=C1CC)C(O)=O
MCULE-8427715730 0.60 C(O)(=O)C1=CC=C(C=C1)OCC1=CC=CC=C1
MCULE-8703533029 0.60 CC1C=CC(C(=O)O)=CC=1CO
MCULE-2693295873 0.60 C(OC)(=O)C1=CC=C(OC(C)C)C=C1
MCULE-3231245614 0.60 C1(C(OCC)=O)=C(O)C=C2C(C=CC=C2)=C1O
MCULE-8115151480 0.60 C12=CC=C(OCC)C=C1C=CC(C=O)=C2
MCULE-5717907162 0.60 C1(O)=CC(C)=CC=C1C
MCULE-5966911451 0.60 C1(C=CC=CC=1C)COC1C=CC=C(C=1)C=O
MCULE-2281777518 0.60 C(O)(=O)C1C=CC(=CC=1)COC1=CC=C(C=C1)C
MCULE-1222282013 0.60 C1(=CC(OC)=CC=C1C#N)C(O)=O
MCULE-9506807273 0.60 P(O)(O)(=O)OC1=CC=CC(=C1)C(O)=O
MCULE-2185855925 0.60 CC(C1=C(O)C(C=O)=CC(O)=C1)(C)C
MCULE-5987859399 0.60 C1(O)C(C(C)C)=CC(C(O)=O)=CC=1C(C)C
MCULE-5322266740 0.60 C1(C(O)=O)=CC(Cl)=C2C(C=CC=C2)=C1O
MCULE-3731325036 0.60 CC1C(C(O)=O)=CC=CC=1OC(F)(F)F
MCULE-8207527442 0.60 C1(O)C(CO)=C(C)C=C(C)C=1CO
MCULE-1294709490 0.60 C1(OC)=CC(=CC=C1O)C=O
MCULE-1791513834 0.60 C(ON)(=O)C1=CC=C(C=C1)OC
MCULE-7454548062 0.60 C1(O)=C2C(C=CC=C2O)=CC=C1C=O
MCULE-8479664920 0.60 C(OCC)(=O)C1=CC=C(C=C1)OC
MCULE-3088068979 0.60 NC1=CC(C(O)=O)=C(Br)C(O)=C1
MCULE-3602064584 0.60 C1(C(O)=O)C(O)=CC(=C(COC)C=1)C
MCULE-3247108541 0.60 COC(C1=CC=C(COC(C2=CC(OC)=CC(OC)=C2)=O)C=C1)=O
MCULE-4525231266 0.60 C1(C=C(Br)C=C(CO)C=1O)C(O)=O
MCULE-8078723892 0.60 C(O)(=O)C1C=CC2C(=CC=C(F)C=2)C=1
MCULE-6774983900 0.60 C1C(C(=O)O)=C(C)C=C(C)C=1C
MCULE-1919162992 0.60 O=CC1C(C)=C(OC)C=CC=1
MCULE-7047631074 0.60 O=CC1=CC=C(C=C1)COC
MCULE-5594977554 0.60 C1(C(=O)OC)=CC(=CC=C1OC)OC
MCULE-5933061630 0.60 C1(=CC=CC(=C1C)C(=O)O)OC(=O)C
MCULE-1015656673 0.60 C1=C(Br)C(O)=CC(=C1C(=O)O)O
MCULE-3815920396 0.60 C1(C=C(OC)C=CC=1C=O)C(OC)=O
MCULE-5875631097 0.60 C1(C=C(C=CC=1C(O)=O)OC1C=CC(=C(C(O)=O)C=1)C(O)=O)C(O)=O
MCULE-4369459778 0.60 OCC1C=C(OC)C=C(C)C=1
MCULE-8853415266 0.60 O=C(C1C(Cl)=CC(C)=C(O)C=1)OC
MCULE-5916291254 0.60 O=C(C1C(N)=CC=C(OC(C)C)C=1)O
MCULE-8256272016 0.60 O=C(C1C(OC)=CC(C=O)=CC=1)OC
MCULE-8800323152 0.60 C(O)(=O)C1C=CC(=CC=1)COC1=CC=C(C=C1)OCC
MCULE-3302389651 0.60 O(C)C1=C(C=C(C=C1C(=O)O)OC)OC
MCULE-8715270050 0.60 C1(O)C=C2C=C(C(=O)O)C=C(C3C=C(O)C(O)=CC=3)C2=CC=1O
MCULE-5743836412 0.60 O(C)C(C1=CC=C(C(=O)[O-])C=C1)=O.[K+]
MCULE-5861198770 0.60 N(=O)(=O)C1=CC(O)=CC(C(O)=O)=C1
MCULE-2918056790 0.60 C(C1=CC=CC=C1)(=O)C1C=CC=C(O)C=1
MCULE-6209067251 0.60 O=C(C1C(O)=C(C#N)C=CC=1)O
MCULE-1545683836 0.60 C12C=CC(=CC1=CC=C(OC)C=2Cl)C(O)=O
MCULE-3357079002 0.60 C12C=CC=C(C(OC)=O)C=1C=CC=C2C(OC)=O
MCULE-8897020648 0.60 O=C(C1C=CC(C(C)O)=CC=1)O
MCULE-4041400636 0.60 C(OC)(=O)C1=CC=C(C=C1)COC1=CC=CC2C=CC=CC1=2
MCULE-6308479858 0.60 CC(C1=C(O)C(C)=C(C)C=C1)=O
MCULE-7557150204 0.60 C(=O)(OC1C=CC=C(C=1)C(OC)=O)C1C=CC=C2C=CC=CC=12
MCULE-7443817091 0.60 C(=O)C1=CC(OC)=CC=C1C
MCULE-5861918000 0.60 C1(C=O)=CC(C)=CC(C=O)=C1O
MCULE-8858015702 0.60 OC(C1=CC(OC2CCCC2)=CC=C1)=O
MCULE-9343864345 0.60 C1(=CC=C(C(=O)O)C=C1)OC1C=CC=C(O)C=1
MCULE-2309502237 0.60 OC(C1=CC(OC2=CC(C(F)(F)F)=CC=C2)=CC=C1)=O
MCULE-9479789486 0.60 C(O)(=O)C1=CC(C=O)=CC=C1C
MCULE-3356004255 0.60 CC1=C(C)C(C)=C(C(O)=O)C(C)=C1C
MCULE-2807971585 0.60 C1=C2C(C(C(OC)=O)=C3C(=C2C(O)=O)C=CC=C3)=CC=C1
MCULE-9258210764 0.60 C(OC)(=O)C1C=CC(=C(OC)C=1)N
MCULE-6605919323 0.60 C1(C(O)=O)C(C)=C(C)C(=C(C)C=1C)C(O)=O
MCULE-5606683828 0.60 O=C(C1=CC=CC=C1)OC1=CC=CC=C1
MCULE-3372307228 0.60 COC(C1=CC(F)=C(C)C(O)=C1)=O
MCULE-4919305677 0.60 C(#N)C1=CC=C(C=O)C(O)=C1
MCULE-1890430975 0.60 OC1=CC=C(C(OCC2=CC(COC(C3=CC=C(O)C=C3)=O)=CC=C2)=O)C=C1
MCULE-1881976532 0.60 O=C(C1=CC(OC2=CC=CC=C2)=CC=C1)OCC1=CC=C(COC(C2=CC(OC3=CC=CC=C3)=CC=C2)=O)C=C1
MCULE-7225010528 0.60 C1(OCC2C=C(C(=O)OC)C=CC=2)=CC=CC(C=O)=C1
MCULE-1480074675 0.60 C1C(O)=CC(=CC=1F)C=O
MCULE-7108380205 0.60 C1(=CC=C(C2=CC=CC=C12)C)C(OC)=O
MCULE-3526696401 0.60 C1C(Br)=CC2C=CC(C(O)=O)=CC=2C=1
MCULE-2920902245 0.60 C(=O)(OC1C=CC=C(CO)C=1)C1C=CC=C2C=CC=CC=12
MCULE-6389850503 0.60 C1(C=O)C(O)=CC(=CC=1O)O
MCULE-8747805003 0.60 O=CC1C=C(OCC)C(C)=CC=1
MCULE-7912792561 0.60 OC(C1=CC(OCC(F)(F)F)=CC(OCC(F)(F)F)=C1)=O
MCULE-1919287187 0.60 C1(O)=CC(O)=CC=C1C=O
MCULE-1555364343 0.60 C(=O)(OC1=CC=C(C=C1)C=O)C1=CC=CC(OC)=C1
MCULE-2041861989 0.60 O=C(O)C1C=C(O)C=C(C2C=C(C#N)C=CC=2)C=1
MCULE-7834160714 0.60 C(F)(F)(F)CCOC1=CC=CC(=C1)C(O)=O
MCULE-4005334204 0.60 C(OC)(C1C2C3C(=CC=CC=3C=CC=2C=CC=1)C(OC)=O)=O
MCULE-2214676510 0.60 NC1=C(C(O)=O)C=C(O)C(F)=C1
MCULE-5462426543 0.60 COC1C(O)=CC(C(=O)O)=C(Br)C=1
MCULE-6467981343 0.60 C1(C=O)=CC=C(C=C1OC)C
MCULE-1893993072 0.60 O=C(C1C(C)=CC(C(=O)O)=CC=1)O
MCULE-6753292144 0.60 COC1C(OC)=CC(C(=O)O)=C(O)C=1
MCULE-6346820029 0.60 CC(C1=CC2=C(C=C(C=C2)O)C=C1)=O
MCULE-2886493836 0.60 C1(C=C(C=O)C=C(C=O)C=1O)C(OC)=O
MCULE-5998143444 0.60 C1(O)C(I)=CC(=CC=1I)C(O)=O
MCULE-1899862083 0.60 C(N)(=O)OC1=CC=CC(=C1)C(OC)=O
MCULE-9640850926 0.60 COC1C=CC(C(=O)[O-])=C(O)C=1.[K+]
MCULE-8751770738 0.60 C1(C(O)=O)C(C)=CC(=C(C)C=1)C(O)=O
MCULE-4966821412 0.60 Cl.C(OC)(=O)C1=CC=CC(OCCN)=C1
MCULE-9435091377 0.60 C1(=CC=C(C2=CC=CC=C12)OCC(C)C)C(O)=O
MCULE-8012616289 0.60 C12C=CC=CC=1C(=C1C=CC=CC1=C2C(=O)OC)C
MCULE-8087260604 0.60 C(O)(=O)C1C=CC(=CC=1)COC1=CC=C(C=C1)OC
MCULE-2673447545 0.60 CCOC(C1=CC(OC)=C(OC)C=C1)=O
MCULE-8998687249 0.60 C12C=C(CO)C=CC1=CC=C(OC)C=2
MCULE-6944424162 0.60 O(C(C)C)CC1=CC=CC(O)=C1
MCULE-1054484497 0.60 O=C(OC)C1C(O)=CC(C2C=CC=CC=2)=CC=1
MCULE-5254211769 0.60 O=C(OC)C1=C(O)C(C)=CC(C)=C1O
MCULE-9238693738 0.60 COC(C1=CC(OCC(F)(F)F)=CC=C1)=O
MCULE-5294911214 0.60 COC1=CC(C(O)=O)=C(C(Cl)Cl)C=C1
MCULE-6701332982 0.60 OC1=CC(=C(O)C=C1)C(=O)OCC1C=CC(C#N)=CC=1
MCULE-5486422687 0.60 CC(C1=CC=C(C(O)=O)C=C1)=O
MCULE-3725920904 0.60 OC(C1=C(F)C(O)=C(F)C(F)=C1)=O
MCULE-2736846762 0.60 OC(C1=CC2=C(NN=C2)C=C1)=O
MCULE-8546042962 0.60 C1(OCC)=C(OC)C=C(C=C1OC)C(O)=O
MCULE-8885057432 0.60 C(O)(=O)C1C=CC=C(C=1)OCC(COC)O
MCULE-2732488863 0.60 O=C(C1C=C2C(C=C(C=C2)Cl)=CC=1)O
MCULE-8814701021 0.60 C12C=CC(=CC1=CC=C(OC)C=2Br)C(O)=O
MCULE-3443358998 0.60 C(O)(=O)C1C=CC=C(C=1)OCC1CC(C1)C
MCULE-2119053411 0.60 C1(C(O)=O)C(OC)=CC2C(=CC=CC=2)C=1OC
MCULE-4312029180 0.60 C1(C(=O)OC)=CC2C(C(OC)=O)=CC=CC=2C=C1
MCULE-7714487865 0.60 O=C(O)C1C(C)=C(C)C(C)=C(C)C=1
MCULE-1415451753 0.60 C1(C(C)(C)C)=CC(C(O)=O)=CC(C(C)(C)C)=C1O
MCULE-8530842553 0.60 COC1=C(Br)C(OC)=CC(C(O)=O)=C1
MCULE-4426932169 0.60 O=C(O)C1C(C)=C(C)C(C)=CC=1C
MCULE-9016032064 0.60 COC1=CC2=C(C=C(C=C2)C=O)C=C1
MCULE-9942425563 0.60 C1(C(=O)O)=C(OC)C=CC(OC)=C1OC
MCULE-3535374816 0.60 NC1=CC=C(C(O)=O)C=C1
MCULE-2726007963 0.60 C1(C)C(C)=C(C)C=CC=1C(O)=O
MCULE-9152503324 0.60 COC1=CC(C=O)=C(O)C=C1
MCULE-6496975258 0.60 CC[N+](CC1=CC=CC=C1)(CC)CC.OC1=C(C([O-])=O)C=CC=C1
MCULE-7927800687 0.60 C(=O)C1=CC=CC(O)=C1OC