| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: 5-[2-cyanoethyl(isobutyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic 5-[2-cyanoethyl(isobutyl)amino]-…
| 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) | 0.91 | 8.64 | -45.89 | 0 | 6 | -1 | 85 | 263.321 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 8.77 | -37.01 | 1 | 6 | 0 | 86 | 264.329 | 6 | ↓ |
