| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 24 | Yes |
Popular Name: 5-[3-(4-methylpiperazin-1-yl)propyl]-2-(4-methyl-1-piperidyl)aniline 5-[3-(4-methylpiperazin-1-yl)pro…
| 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) | 3.22 | 9.12 | -35.07 | 3 | 4 | 1 | 37 | 331.528 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 6.87 | -2.72 | 2 | 4 | 0 | 36 | 330.52 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 9.16 | -77.43 | 4 | 4 | 2 | 38 | 332.536 | 5 | ↓ |
