In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 31 | No |
Popular Name: (Z)-N-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]methyl]-3-phenyl-prop-2-enamide (Z)-N-[[1-[2-(azepan-1-yl)-2-oxo…
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) | 3.60 | 11.68 | -18.99 | 1 | 6 | 0 | 67 | 416.525 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.60 | 12.13 | -33.3 | 2 | 6 | 1 | 68 | 417.533 | 6 | ↓ |