| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 18 | No |
Popular Name: 2-methylene-4-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)butanoic 2-methylene-4-oxo-4-(2-oxo-3H-1,…
| 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) | 0.77 | 4.35 | -59.5 | 1 | 6 | -1 | 103 | 246.198 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 1.73 | -102.86 | 0 | 6 | -2 | 106 | 245.19 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5147883 | IBM Patent Data |
