| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 24 | No |
Popular Name: (3S)-3-phenyl-4-[3-(4-pyridyl)-5-sulfanyl-1,2,4-triazol-4-yl]butanoic (3S)-3-phenyl-4-[3-(4-pyridyl)-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) | 0.79 | 9.31 | -115.47 | 0 | 6 | -2 | 84 | 338.392 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.06 | 9.46 | -58.85 | 1 | 6 | -1 | 87 | 339.4 | 6 | ↓ |
