In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 27 | Yes |
Popular Name: 1-[3-(4-benzylpiperazin-1-yl)propyl]-3-(2-chlorophenyl)urea 1-[3-(4-benzylpiperazin-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) | 3.67 | 8.47 | -47.95 | 3 | 5 | 1 | 49 | 387.935 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 8.55 | -44.91 | 3 | 5 | 1 | 49 | 387.935 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 6.17 | -10.54 | 2 | 5 | 0 | 48 | 386.927 | 7 | ↓ |