In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 32 | Yes |
Popular Name: N-[(1S)-1-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-3-chloro-benzamide N-[(1S)-1-[1-[3-(azepan-1-yl)-3-…
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) | 4.44 | 12.35 | -13.46 | 1 | 6 | 0 | 67 | 452.986 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.44 | 12.87 | -40.71 | 2 | 6 | 1 | 68 | 453.994 | 6 | ↓ |