| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2010 | 8 | Yes |
Popular Name: 7-oxabicyclo[2.2.1]heptan-2-amine 7-oxabicyclo[2.2.1]heptan-2-amine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1314954-35-2 , 1354943-00-2 , 54745-74-3
(2S)-7-oxabicyclo[2.2.1]heptan-2-amine
8-Oxa-3-azabicyclo[3.2.1]octane hydrochloride, 97%
| 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) | -0.33 | 0.28 | -44.93 | 3 | 2 | 1 | 37 | 114.168 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | 0.09 | -2.46 | 2 | 2 | 0 | 35 | 113.16 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.