In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 33 | Yes |
Popular Name: N-(2-cyanoethyl)-5-(4-fluorophenyl)-2-(p-tolyl)-N-(3-pyridylmethyl)pyrazole-3-carboxamide N-(2-cyanoethyl)-5-(4-fluorophen…
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) | 3.24 | 13.3 | -17.51 | 0 | 6 | 0 | 75 | 439.494 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.24 | 13.59 | -45.86 | 1 | 6 | 1 | 76 | 440.502 | 7 | ↓ |