In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 25 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[(3-chlorophenyl)methyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[(3-chlo…
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) | 5.07 | 13.61 | -41.58 | 1 | 3 | 1 | 22 | 354.905 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.07 | 11.68 | -7.82 | 0 | 3 | 0 | 21 | 353.897 | 4 | ↓ |