| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-N-[(1S)-1-(m-tolyl)ethyl]propan-1-amine 3-(4-methylpiperazin-1-yl)-N-[(1…
| 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) | 2.67 | 8.02 | -87.95 | 3 | 3 | 2 | 24 | 277.456 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 7.92 | -108.5 | 3 | 3 | 2 | 24 | 277.456 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 5.65 | -40.24 | 2 | 3 | 1 | 23 | 276.448 | 6 | ↓ |
