| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 21 | Yes |
Popular Name: 1-[4-[(3S)-3-(4-methylpiperazin-1-yl)butoxy]phenyl]ethanone 1-[4-[(3S)-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) | 2.42 | 7.55 | -42.91 | 1 | 4 | 1 | 34 | 291.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 5.08 | -7.71 | 0 | 4 | 0 | 33 | 290.407 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 7.1 | -46.52 | 1 | 4 | 1 | 34 | 291.415 | 6 | ↓ |
