| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | Yes |
Popular Name: 4-[(2S)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]butanenitrile 4-[(2S)-2-(1-methylpyrazol-4-yl)…
| 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) | 0.43 | 7.2 | -48.08 | 1 | 4 | 1 | 46 | 219.312 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.43 | 5.23 | -12 | 0 | 4 | 0 | 45 | 218.304 | 4 | ↓ |
