In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2008 | 33 | No |
Popular Name: 5-(3-methoxyphenyl)-2-(3-nitrophenyl)-N-[2-(2-pyridyl)ethyl]pyrazole-3-carboxamide 5-(3-methoxyphenyl)-2-(3-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) | 3.58 | 10.23 | -21.05 | 1 | 9 | 0 | 115 | 443.463 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 10.51 | -53.63 | 2 | 9 | 1 | 116 | 444.471 | 8 | ↓ |