In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 27 | Yes |
Popular Name: 2-[(1S)-1-(azepan-1-yl)ethyl]-1-[(3,4-dichlorophenyl)methyl]benzimidazole 2-[(1S)-1-(azepan-1-yl)ethyl]-1-…
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) | 6.26 | 13.84 | -44.66 | 1 | 3 | 1 | 22 | 403.377 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.26 | 11.95 | -9.63 | 0 | 3 | 0 | 21 | 402.369 | 4 | ↓ |