In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 27 | Yes |
Popular Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-1-(4-methoxyphenyl)urea 3-[2-(4-benzylpiperazin-1-yl)eth…
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) | 2.82 | 6.4 | -51.25 | 3 | 6 | 1 | 58 | 369.489 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 6.46 | -49.76 | 3 | 6 | 1 | 58 | 369.489 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 4.08 | -15.56 | 2 | 6 | 0 | 57 | 368.481 | 7 | ↓ |