| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 15 | Yes |
Popular Name: (2S)-1-(4-methylpiperazin-1-yl)-3-(propylamino)propan-2-ol (2S)-1-(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) | -0.10 | 1.44 | -84.1 | 4 | 4 | 2 | 45 | 217.357 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.10 | -2.29 | -3.1 | 2 | 4 | 0 | 39 | 215.341 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | -0.93 | -39.02 | 3 | 4 | 1 | 43 | 216.349 | 6 | ↓ |
