| Mol ID | Molecule name | MW | AlogP | Hdon | Hacc | OB (%) | DL |
| Momordicae semen | MOL012377 | Bessisterol | 412.77 | 7.64 | 1 | 1 | 42.98 | 0.76 | MOL012375 | Monachosorin A | 404.54 | 4.76 | 2 | 4 | 37.3 | 0.71 | MOL012374 | Momordic acid | 470.76 | 5.46 | 2 | 4 | 36.36 | 0.75 | MOL006756 | Schottenol | 414.79 | 8.08 | 1 | 1 | 37.42 | 0.75 | MOL006353 | Stigmast-4-ene-3,6a-diol | 430.79 | 7.12 | 2 | 2 | 34.37 | 0.78 | MOL001297 | trans-Gondoic acid | 310.58 | 7.75 | 1 | 2 | 30.7 | 0.2 | MOL000358 | Beta-sitosterol | 414.79 | 8.08 | 1 | 1 | 36.91 | 0.75 | MOL000263 | Oleanolic acid | 456.78 | 6.42 | 2 | 3 | 29.02 | 0.76 | MOL001640 | NON | 172.3 | 3.63 | 1 | 2 | 26.74 | 0.03 | MOL007186 | Karounidiol | 440.78 | 5.96 | 2 | 2 | 26.26 | 0.77 | MOL012372 | (3R,4aR,6aS,6bS,8aS,11R,12aR,14bS)-4,4,6a,6b,8a,11,14b-heptamethyl-11-methylol-1,2,3,4a,7,8,9,10,12,12a,13,14-dodecahydropicen-3-ol | 440.78 | 5.96 | 2 | 2 | 28.3 | 0.77 |
| Epimedii herba | MOL001510 | 24-Epicampesterol | 400.76 | 7.63 | 1 | 1 | 37.58 | 0.71 | MOL001645 | Linoleyl acetate | 308.56 | 6.85 | 0 | 2 | 42.1 | 0.2 | MOL001771 | Poriferast-5-en-3beta-ol | 414.79 | 8.08 | 1 | 1 | 36.91 | 0.75 | MOL001792 | DFV | 256.27 | 2.57 | 2 | 4 | 32.76 | 0.18 | MOL003044 | Chryseriol | 300.28 | 2.32 | 3 | 6 | 35.85 | 0.27 | MOL003542 | 8-Isopentenyl-kaempferol | 354.38 | 3.63 | 4 | 6 | 38.04 | 0.39 | MOL000359 | Sitosterol | 414.79 | 8.08 | 1 | 1 | 36.91 | 0.75 | MOL000422 | Kaempferol | 286.25 | 1.77 | 4 | 6 | 41.88 | 0.24 | MOL004367 | Olivil | 376.44 | 1.68 | 4 | 7 | 62.23 | 0.41 | MOL004373 | Anhydroicaritin | 368.41 | 3.88 | 3 | 6 | 45.41 | 0.44 | MOL004380 | C-Homoerythrinan, 1,6-didYYHydro-3,15,16-trimethoxy-, (3.beta.)- | 329.48 | 2.89 | 0 | 4 | 39.14 | 0.49 | MOL004382 | Yinyanghuo A | 420.49 | 4.2 | 3 | 6 | 56.96 | 0.77 | MOL004384 | Yinyanghuo C | 336.36 | 3.39 | 2 | 5 | 45.67 | 0.5 | MOL004386 | Yinyanghuo E | 352.36 | 3.12 | 3 | 6 | 51.63 | 0.55 | MOL004388 | 6-Hydroxy-11,12-dimethoxy-2,2-dimethyl-1,8-dioxo-2,3,4,8-tetrahydro-1H-isochromeno[3,4-h]isoquinolin-2-ium | 370.41 | 2.75 | 1 | 6 | 60.64 | 0.66 | MOL004391 | 8-(3-Methylbut-2-enyl)-2-phenyl-chromone | 290.38 | 4.99 | 0 | 2 | 48.54 | 0.25 | MOL004394 | Anhydroicaritin-3-O-alpha-L-rhamnoside | 676.73 | 0.77 | 8 | 15 | 41.58 | 0.61 | MOL004396 | 1,2-bis (4-Hydroxy-3-methoxyphenyl) propan-1,3-diol | 320.37 | 1.69 | 4 | 6 | 52.31 | 0.22 | MOL004425 | Icariin | 676.73 | 0.77 | 8 | 15 | 41.58 | 0.61 | MOL004427 | Icariside A7 | 462.49 | 1.16 | 5 | 10 | 31.91 | 0.86 | MOL000006 | Luteolin | 286.25 | 2.07 | 4 | 6 | 36.16 | 0.25 | MOL000622 | Magnograndiolide | 266.37 | 1.18 | 2 | 4 | 63.71 | 0.19 | MOL000098 | Quercetin | 302.25 | 1.5 | 5 | 7 | 46.43 | 0.28 |
|
|