In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 36 | Yes |
Popular Name: 3-methoxy-N-[6-[4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 3-methoxy-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) | 3.85 | 11.39 | -17.31 | 1 | 7 | 0 | 75 | 498.505 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.85 | 11.7 | -49.37 | 2 | 7 | 1 | 76 | 499.513 | 6 | ↓ |