In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2009 | 16 | Yes |
Popular Name: (2-BENZO[1,3]DIOXOL-5-YL-THIAZOL-4-YL)-METHANOL (2-BENZO[1,3]DIOXOL-5-YL-THIAZOL…
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CAS Number: 248249-56-1
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) | 2.25 | 1.46 | -8.49 | 1 | 4 | 0 | 52 | 235.264 | 2 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO1999055318A1 | IBM Patent Data |