In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 26 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[(2,5-dimethylphenyl)methyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[(2,5-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) | 5.24 | 13.54 | -40.65 | 1 | 3 | 1 | 22 | 348.514 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.24 | 11.64 | -8.54 | 0 | 3 | 0 | 21 | 347.506 | 4 | ↓ |