In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 29 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[3-(3,4-dimethylphenoxy)propyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[3-(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) | 5.60 | 14.82 | -43.03 | 1 | 4 | 1 | 31 | 392.567 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.60 | 13.38 | -10.01 | 0 | 4 | 0 | 30 | 391.559 | 7 | ↓ |