In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 16th, 2006 | 18 | Yes |
Popular Name: N-(4-cyanophenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide N-(4-cyanophenyl)-2-(4H-1,2,4-tr…
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) | 0.87 | 5.19 | -15.08 | 2 | 6 | 0 | 94 | 259.294 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 5.03 | -43.81 | 1 | 6 | -1 | 93 | 258.286 | 4 | ↓ |