| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 27 | No |
Popular Name: (2S)-2-[[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-nitrophenyl)propanamide (2S)-2-[[5-(4-chlorophenyl)-4H-1…
| 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) | 4.23 | 9.6 | -24.42 | 2 | 8 | 0 | 116 | 403.851 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.23 | 9.5 | -43.97 | 1 | 8 | -1 | 115 | 402.843 | 6 | ↓ |
