| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 17 | Yes |
Popular Name: (2S)-1-methylamino-3-[3-(4-methylpiperazin-1-yl)propoxy]propan-2-ol (2S)-1-methylamino-3-[3-(4-methy…
| 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) | -0.37 | 0.87 | -78.2 | 4 | 5 | 2 | 54 | 247.383 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.37 | -1.6 | -37.12 | 3 | 5 | 1 | 53 | 246.375 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.37 | -3.09 | -4.33 | 2 | 5 | 0 | 48 | 245.367 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.37 | 0.73 | -83.47 | 4 | 5 | 2 | 54 | 247.383 | 8 | ↓ |
