In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 27 | Yes |
Popular Name: 1-(azepan-1-yl)-2-[2-(azepan-1-ylmethyl)benzimidazol-1-yl]ethanone 1-(azepan-1-yl)-2-[2-(azepan-1-y…
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) | 3.58 | 12.68 | -43.24 | 1 | 5 | 1 | 43 | 369.533 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.58 | 10.38 | -15.76 | 0 | 5 | 0 | 41 | 368.525 | 4 | ↓ |