In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: 2-[3-(azepan-1-yl)propyl]-1-[2-(3,4-dimethylphenoxy)ethyl]benzimidazole 2-[3-(azepan-1-yl)propyl]-1-[2-(…
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) | 6.00 | 15.51 | -42.59 | 1 | 4 | 1 | 31 | 406.594 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.00 | 15.82 | -95.87 | 2 | 4 | 2 | 33 | 407.602 | 8 | ↓ |