In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 30 | Yes |
Popular Name: N-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-2-carboxamide N-[[1-[2-(azepan-1-yl)-2-oxo-eth…
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) | 2.03 | 11.56 | -15.4 | 0 | 7 | 0 | 71 | 405.502 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 12.38 | -30.8 | 1 | 7 | 1 | 73 | 406.51 | 5 | ↓ |