In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 32 | Yes |
Popular Name: 2-[3-(azepan-1-yl)propyl]-1-[4-(3-methoxyphenoxy)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) | 5.75 | 15.13 | -49.17 | 1 | 5 | 1 | 41 | 436.62 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.75 | 15.43 | -104.1 | 2 | 5 | 2 | 42 | 437.628 | 11 | ↓ |