| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 22 | Yes |
Popular Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)thio]-N-(2-pyridyl)acetamide 2-[(3-phenyl-1H-1,2,4-triazol-5-…
| 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) | 2.33 | 7.44 | -18.12 | 2 | 6 | 0 | 84 | 311.37 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 7.3 | -54.97 | 1 | 6 | -1 | 82 | 310.362 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.33 | 7.52 | -35.52 | 3 | 6 | 1 | 85 | 312.378 | 5 | ↓ |
