| Mol ID | Mol name | 2D structure | OB (%) | DL |
| MOL000263 | Oleanolic acid | | 29.02 | 0.76 | MOL000298 | Ergosterol | | 14.29 | 0.72 | MOL000511 | Ursolic acid | | 16.77 | 0.75 | MOL008834 | Bilicerdin | | 23.79 | 0.75 | MOL008835 | 3-[2-[[3-(2-Carboxyethyl)-4-methyl-5-[(E)-(4-methyl-5-oxo-3-vinyl-2-pyrrolylidene)methyl]-1H-pyrrol-2-yl]methyl]-4-methyl-5-[(Z)-(3-methyl-5-oxo-4-vinyl-2-pyrrolylidene)methyl]-1H-pyrrol-3-yl]propanoic acid | | 16.53 | 0.75 | MOL008838 | Methyl (4R)-4-[(3R,5S,7S,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate | | 32.32 | 0.76 | MOL008839 | Methyl desoxycholate | | 34.63 | 0.73 | MOL008840 | 2-[(3alpha,12alpha-Dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid | | 15.92 | 0.87 | MOL008843 | Cherianoine | | 27.32 | 0.12 | MOL008846 | ZINC01280365 | | 46.38 | 0.49 | MOL000953 | CLR | | 37.87 | 0.68 | MOL009807 | CHD | | 22.17 | 0.72 |
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