| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 13 | No |
Popular Name: ethyl 2-oxo-2-(2-oxocyclopentyl)acetate ethyl 2-oxo-2-(2-oxocyclopentyl)…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 20826-94-2 , 39163-39-8
| 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) | 0.52 | 5.22 | -44.23 | 0 | 4 | -1 | 66 | 183.183 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.52 | 4.53 | -5.61 | 1 | 4 | 0 | 64 | 184.191 | 4 | ↓ |
| 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.