In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 17 | Yes |
Popular Name: 2-[methyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]ethanol 2-[methyl-(5-methyl-4-phenyl-thi…
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) | 2.36 | 5.5 | -8.38 | 1 | 3 | 0 | 36 | 248.351 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 5.89 | -23.42 | 2 | 3 | 1 | 38 | 249.359 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5002953; US5194443; US5232925; US5260445; US5521201; US5646169 | IBM Patent Data |