| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 26 | Yes |
Popular Name: 2-[(3S)-3-methylpiperazin-1-yl]-N-(4-phenylbutyl)pyridine-3-carboxamide 2-[(3S)-3-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) | 2.86 | 9.59 | -37.25 | 3 | 5 | 1 | 62 | 353.49 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 8.34 | -11.39 | 2 | 5 | 0 | 57 | 352.482 | 7 | ↓ |
