In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 33 | Yes |
Popular Name: 1-[4-(2-allylphenoxy)butyl]-2-[3-(azepan-1-yl)propyl]benzimidazole 1-[4-(2-allylphenoxy)butyl]-2-[3…
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) | 6.49 | 17.89 | -47.47 | 1 | 4 | 1 | 31 | 446.659 | 12 | ↓ |
Mid Mid (pH 6-8) | 6.49 | 18.19 | -101.84 | 2 | 4 | 2 | 33 | 447.667 | 12 | ↓ |