In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 33 | Yes |
Popular Name: N-[(1S)-1-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide 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) | 4.40 | 13.31 | -12.68 | 1 | 6 | 0 | 67 | 446.595 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 13.84 | -36.91 | 2 | 6 | 1 | 68 | 447.603 | 8 | ↓ |