In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 35 | Yes |
Popular Name: 1-[6-[4-(2-chlorobenzoyl)piperazin-1-yl]-3-pyridyl]-3-[4-(trifluoromethyl)phenyl]urea 1-[6-[4-(2-chlorobenzoyl)piperaz…
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) | 4.49 | 11.07 | -47.77 | 3 | 7 | 1 | 79 | 504.92 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 10.75 | -18.02 | 2 | 7 | 0 | 78 | 503.912 | 5 | ↓ |