In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 25 | No |
Popular Name: 4-[2-[methyl-(4-methyl-5-phenyl-thiazol-2-yl)amino]ethoxy]benzaldehyde 4-[2-[methyl-(4-methyl-5-phenyl-…
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) | 4.71 | 11.09 | -11 | 0 | 4 | 0 | 42 | 352.459 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.71 | 11.5 | -33.67 | 1 | 4 | 1 | 44 | 353.467 | 7 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US5002953; US5194443; US5232925; US5260445; US5521201; US5646169 | IBM Patent Data |