| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2010 | 23 | Yes |
Popular Name: 4-[[methyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]benzonitrile 4-[[methyl-[(4-pyrazol-1-ylpheny…
| 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) | 2.62 | 9.26 | -11.55 | 0 | 4 | 0 | 45 | 302.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 11.58 | -59.57 | 1 | 4 | 1 | 46 | 303.389 | 5 | ↓ |
