| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 29 | No |
Popular Name: 2-[[5-(3-isopropoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)acetamide 2-[[5-(3-isopropoxyphenyl)-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) | 3.94 | 9.32 | -20.22 | 2 | 9 | 0 | 126 | 413.459 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 9.12 | -54.63 | 1 | 9 | -1 | 124 | 412.451 | 8 | ↓ |
