| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 15 | Yes |
Popular Name: 4-(methoxycarbonyl)bicyclo[2.2.2]octane-1-carboxylic acid 4-(methoxycarbonyl)bicyclo[2.2.2…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 18720-35-9 , [18720-35-9]
| 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) | 0.91 | 5.77 | -47.4 | 0 | 4 | -1 | 66 | 211.237 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.91 | 4.65 | -9.47 | 1 | 4 | 0 | 64 | 212.245 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
