| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 21 | Yes |
Popular Name: 2-[(1S)-1-[3-(4-methylpiperazin-1-yl)propylamino]ethyl]benzene-1,4-diol 2-[(1S)-1-[3-(4-methylpiperazin-…
| 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) | 1.69 | 2 | -89.12 | 5 | 5 | 2 | 65 | 295.427 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 1.87 | -108.9 | 5 | 5 | 2 | 65 | 295.427 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | -0.47 | -41.9 | 4 | 5 | 1 | 64 | 294.419 | 6 | ↓ |
