| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-2-(4-methylpiperazin-1-yl)-1-(p-tolyl)propan-1-one (2S)-2-(4-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) | 2.16 | 6.77 | -36.37 | 1 | 3 | 1 | 25 | 247.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 4.4 | -6.82 | 0 | 3 | 0 | 24 | 246.354 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 6.78 | -34.16 | 1 | 3 | 1 | 25 | 247.362 | 3 | ↓ |
