| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 28 | Yes |
Popular Name: 2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2,4-dihydroxyphenyl)ethanone 2-[[4-allyl-5-(2-methoxyphenyl)-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.73 | 7.47 | -23.01 | 2 | 7 | 0 | 97 | 397.456 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 9.3 | -132.53 | 0 | 7 | -2 | 103 | 395.44 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 8.5 | -59.17 | 1 | 7 | -1 | 100 | 396.448 | 8 | ↓ |
