In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2005 | 31 | Yes |
Popular Name: N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]benzamide N-[3-[4-(2,3-dimethylphenyl)pipe…
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) | 4.16 | 12.52 | -18.69 | 1 | 5 | 0 | 53 | 413.521 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.23 | 10.1 | -46.29 | 2 | 5 | 1 | 57 | 414.529 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 12.33 | -47.7 | 2 | 5 | 1 | 54 | 414.529 | 4 | ↓ |