In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 28 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[2-(3,4-dimethylphenoxy)ethyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[2-(3,4-…
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) | 5.33 | 14.05 | -39.3 | 1 | 4 | 1 | 31 | 378.54 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.33 | 12.58 | -7.03 | 0 | 4 | 0 | 30 | 377.532 | 6 | ↓ |