| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 19 | Yes |
Popular Name: 4-[(2S)-2-methylpiperazin-1-yl]-2-(trifluoromethyl)benzonitrile 4-[(2S)-2-methylpiperazin-1-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) | 2.24 | 6.34 | -50.62 | 2 | 3 | 1 | 44 | 270.278 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 5.01 | -6.3 | 1 | 3 | 0 | 39 | 269.27 | 2 | ↓ |
