In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2005 | 22 | Yes |
Popular Name: N-(2-pyridyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2-pyridyl)-2-[[5-(4-pyridyl)-…
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) | 1.04 | 5.68 | -15.81 | 2 | 7 | 0 | 96 | 312.358 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 5.48 | -48.49 | 1 | 7 | -1 | 95 | 311.35 | 5 | ↓ |