In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: 2-[2-[(1S)-1-(azepan-1-yl)ethyl]benzimidazol-1-yl]-N,N-diisobutyl-acetamide 2-[2-[(1S)-1-(azepan-1-yl)ethyl]…
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) | 4.97 | 14.27 | -41.26 | 1 | 5 | 1 | 43 | 413.63 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 12.96 | -13.54 | 0 | 5 | 0 | 41 | 412.622 | 8 | ↓ |