In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2005 | 14 | Yes |
Popular Name: 6-Bromo-2-trifluoromethyl-3H-imidazo[4,5-b]pyridine 6-Bromo-2-trifluoromethyl-3H-imi…
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CAS Number: 13577-72-5
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) | 2.49 | 3.66 | -32.17 | 0 | 3 | -1 | 40 | 265.012 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | -0.31 | -32.72 | 2 | 3 | 1 | 42 | 267.028 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | 4.06 | -5.23 | 1 | 3 | 0 | 42 | 266.02 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5994389 | IBM Patent Data |