Table 2 The representative phytochemicals of Albizia lebbeck (L.) and their corresponding druglikeness
Compounds | Pubchem /ChEBI ID | Log P | Molecular Weight | H- donor | H-acceptor | Drug Likeness |
|---|---|---|---|---|---|---|
Albigenin | Pubchem 101,280,261 | 6.02 | 426.67 | 1 | 2 | Yes |
Albigenic acid | Pubchem 101,596,822 | 5.42 | 472.7 | 3 | 4 | Yes |
Quebrachitol | ChEBI 111 | −2.26 | 194.18 | 5 | 6 | Yes |
Phytosterol | Pubchem 12,303,662 | 7.19 | 414.17 | 1 | 1 | Yes |
Triterpenoids | Pubchem 71,597,391 | 3.94 | 472.66 | 4 | 5 | Yes |
Alpha Amyrin | Pubchem 225,688 | 7.05 | 426.72 | 1 | 1 | Yes |
Beta Amyrin | Pubchem 225,689 | 7.05 | 426.72 | 1 | 1 | Yes |
Epicatechin | Pubchem 182,232 | 0.85 | 290.27 | 5 | 6 | Yes |
Umbellic acid | Pubchem 446,611 | 0.89 | 180.16 | 3 | 4 | Yes |
Acacic acid | Pubchem 12,305,894 | 4.46 | 488.7 | 4 | 5 | Yes |
Benzoic acid | Pubchem 243 | 1.44 | 122.12 | 1 | 2 | Yes |
Benzyl alcohol | Pubchem 244 | 1.41 | 108.14 | 1 | 1 | Yes |
Celastrol | Pubchem 122,724 | 5.16 | 450.61 | 2 | 4 | Yes |
Digitoxin | Pubchem 441,207 | 2.61 | 764.94 | 5 | 13 | No |
L-arginine monocation | Pubchem 1,549,073 | −3.14 | 175.21 | 4 | 2 | Yes |
Echinocystic acid | Pubchem 73,309 | 5.3 | 472.7 | 3 | 4 | Yes |
Eupatin | Pubchem 5,317,287 | 2.12 | 360.31 | 3 | 8 | Yes |
Friedlein | Pubchem 244,297 | 7.45 | 426.72 | 0 | 1 | Yes |
Kaempferol | Pubchem 5,280,863 | 1.58 | 286.24 | 4 | 6 | Yes |
Ascorbic acid | Pubchem 54,670,067 | −1.28 | 176.12 | 4 | 6 | Yes |
Leucopelargonidin | Pubchem 3,286,789 | 0.58 | 290.27 | 5 | 6 | Yes |
Melacacidin | Pubchem 169,996 | 0.36 | 306.27 | 6 | 7 | Yes |
Melanoxetin | Pubchem 15,560,442 | 1.19 | 302.24 | 5 | 7 | Yes |
Myricitrin | Pubchem 5,281,673 | −0.23 | 464.38 | 8 | 12 | Yes |
Okanin | Pubchem 5,281,294 | 1.69 | 288.25 | 5 | 6 | Yes |
Oleanolic acid | Pubchem 10,494 | 6.06 | 456.7 | 2 | 3 | Yes |
Quercetin | Pubchem 5,280,343 | 1.23 | 302.24 | 5 | 7 | Yes |
Reynoutrin | Pubchem 5,320,863 | 0 | 434.35 | 7 | 11 | No |
Vicenin 2 | Pubchem 3,084,407 | −2.07 | 594.52 | 11 | 15 | No |
Rutin | Pubchem 24,832,108 | −1.12 | 610.52 | 10 | 16 | No |