In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 26 | Yes |
Popular Name: 1-(3,5-dimethylphenyl)-3-[2-(4-phenylpiperazin-1-yl)ethyl]urea 1-(3,5-dimethylphenyl)-3-[2-(4-p…
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) | 3.89 | 9.39 | -49.2 | 3 | 5 | 1 | 49 | 353.49 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 7.17 | -11.08 | 2 | 5 | 0 | 48 | 352.482 | 5 | ↓ |