| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: 1-[(4-cyanophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic 1-[(4-cyanophenyl)methyl]-3,5-di…
| 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) | 1.68 | 8.05 | -51.12 | 0 | 5 | -1 | 82 | 254.269 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.68 | 8.13 | -47.08 | 1 | 5 | 0 | 83 | 255.277 | 3 | ↓ |
