In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 24 | Yes |
Popular Name: 1-[4-(4-methylpiperazin-1-yl)phenyl]-3-(1-methyl-4-piperidyl)urea 1-[4-(4-methylpiperazin-1-yl)phe…
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) | 1.86 | 7.62 | -83.58 | 4 | 6 | 2 | 53 | 333.48 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 5.27 | -42.58 | 3 | 6 | 1 | 52 | 332.472 | 3 | ↓ |