In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 35 | Yes |
Popular Name: N-[6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]-2,4-dimethoxy-benzamide N-[6-[4-(3-chlorobenzoyl)-1,4-di…
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) | 4.17 | 11.35 | -17.3 | 1 | 8 | 0 | 84 | 494.979 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.17 | 11.67 | -46.59 | 2 | 8 | 1 | 85 | 495.987 | 6 | ↓ |