| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2008 | 11 | No |
Popular Name: methyl-(4-oxo-1,3-thiazolidin-2-ylidene)acetate methyl-(4-oxo-1,3-thiazolidin-2-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 26239-22-5 , 56196-66-8
| 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) | -0.23 | 1.91 | -18.09 | 0 | 4 | 0 | 56 | 173.193 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 1.84 | -8.01 | 1 | 4 | 0 | 55 | 173.193 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 2.15 | -8.44 | 1 | 4 | 0 | 55 | 173.193 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0449216A1; EP0449216B1 | IBM Patent Data |
