| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2009 | 18 | Yes |
Popular Name: 4-[(1S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]ethyl]benzonitrile 4-[(1S)-1-[(3,5-dimethyl-1H-pyra…
| 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) | 2.26 | 5.92 | -8.87 | 2 | 4 | 0 | 65 | 240.31 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.26 | 5.74 | -36.04 | 3 | 4 | 1 | 66 | 241.318 | 3 | ↓ |
