In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 34 | Yes |
Popular Name: 2-[3-(azepan-1-yl)propyl]-1-[4-(2-isopropyl-5-methyl-phenoxy)butyl]benzimidazole 2-[3-(azepan-1-yl)propyl]-1-[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) | 7.13 | 18.52 | -45.76 | 1 | 4 | 1 | 31 | 462.702 | 11 | ↓ |
Mid Mid (pH 6-8) | 7.13 | 18.83 | -99.49 | 2 | 4 | 2 | 33 | 463.71 | 11 | ↓ |