| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2009 | 18 | Yes |
Popular Name: 4-[(1S)-1-hydroxy-2-(4-methylpiperazin-1-yl)ethyl]benzonitrile 4-[(1S)-1-hydroxy-2-(4-methylpip…
| 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) | 0.80 | 4 | -40.86 | 2 | 4 | 1 | 52 | 246.334 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 1.61 | -7.44 | 1 | 4 | 0 | 50 | 245.326 | 3 | ↓ |
