In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 33 | Yes |
Popular Name: 2-[3-(azepan-1-yl)propyl]-1-[3-(2-isopropyl-5-methyl-phenoxy)propyl]benzimidazole 2-[3-(azepan-1-yl)propyl]-1-[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) | 6.86 | 17.74 | -46.79 | 1 | 4 | 1 | 31 | 448.675 | 10 | ↓ |
Mid Mid (pH 6-8) | 6.86 | 18.05 | -97.86 | 2 | 4 | 2 | 33 | 449.683 | 10 | ↓ |