In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 32 | No |
Popular Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-N-(3-pyridylmethyl)pyrazole-3-carboxamide 5-(4-methoxyphenyl)-2-(4-nitroph…
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) | 2.94 | 9.44 | -13.89 | 1 | 9 | 0 | 115 | 429.436 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 9.72 | -51.93 | 2 | 9 | 1 | 116 | 430.444 | 7 | ↓ |