In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 34 | Yes |
Popular Name: N-(2-cyanoethyl)-5-(3-methoxyphenyl)-2-(m-tolyl)-N-(3-pyridylmethyl)pyrazole-3-carboxamide N-(2-cyanoethyl)-5-(3-methoxyphe…
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) | 3.30 | 12.5 | -20.37 | 0 | 7 | 0 | 84 | 451.53 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.30 | 12.79 | -47.96 | 1 | 7 | 1 | 85 | 452.538 | 8 | ↓ |