| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 22 | Yes |
Popular Name: [3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]methanamine [3-[4-[(4-methylpiperazin-1-yl)m…
| 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) | 2.59 | 7.15 | -92.36 | 4 | 3 | 2 | 35 | 297.446 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 7.08 | -91.52 | 4 | 3 | 2 | 35 | 297.446 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 4.68 | -48.93 | 3 | 3 | 1 | 34 | 296.438 | 4 | ↓ |
