In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 33 | Yes |
Popular Name: 4-methyl-N-[6-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-3-pyridyl]benzamide 4-methyl-N-[6-[4-[[4-(trifluorom…
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) | 4.84 | 13.49 | -53.01 | 2 | 5 | 1 | 50 | 455.504 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.84 | 11.26 | -11.56 | 1 | 5 | 0 | 48 | 454.496 | 6 | ↓ |