In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 11 | Yes |
Popular Name: (S)-2-Azabicyclo[2.2.2]octane-3-carboxylic acid (S)-2-Azabicyclo[2.2.2]octane-3-…
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CAS Numbers: 109583-12-2 , [109583-12-2]
(3S)-2-azabicyclo[2.2.2]octane-3-carboxylic acid
(3S)-2-azabicyclo[2.2.2]octane-3-carboxylic acid hydrochloride
2-Azabicyclo[2.2.2]octane-3-carboxylic acid, (3S)- (9CI)
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) | -0.96 | 3.04 | -41.31 | 2 | 3 | 0 | 57 | 155.197 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 231 - 233 | Enamine Building Blocks |
MP | 231...233 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |