In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 19 | No |
Popular Name: 2-[4-[(E)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic 2-[4-[(E)-(4-oxo-2-thioxo-thiazo…
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) | 1.59 | 4.32 | -91.67 | 0 | 5 | -2 | 85 | 293.325 | 4 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO2000018747A1 | IBM Patent Data |