In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2009 | 29 | Yes |
Popular Name: 1-benzyl-3-(4-chlorophenyl)-N-(3-pyridylmethyl)pyrazole-4-carboxamide 1-benzyl-3-(4-chlorophenyl)-N-(3…
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) | 3.62 | 10.52 | -15.48 | 1 | 5 | 0 | 60 | 402.885 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 10.96 | -53.41 | 2 | 5 | 1 | 61 | 403.893 | 6 | ↓ |