| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2006 | 10 | Yes |
Popular Name: 4-methoxy-2-methyl-4-oxobutanoic acid 4-methoxy-2-methyl-4-oxobutanoic…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 111266-27-4 , 23268-03-3 , 81025-83-4
| 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) | 0.13 | 2.04 | -43.71 | 0 | 4 | -1 | 66 | 145.134 | 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.