In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 13 | Yes |
Popular Name: 3,8-Diazabicyclo[3.2.1]octane, 3-acetyl-8-ethyl- (9CI) 3,8-Diazabicyclo[3.2.1]octane, 3…
Find On: PubMed — Wikipedia — Google
CAS Number: 807299-54-3
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) | 0.35 | 5.31 | -40.23 | 1 | 3 | 1 | 25 | 183.275 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 3.16 | -7.28 | 0 | 3 | 0 | 24 | 182.267 | 1 | ↓ |