In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 21 | Yes |
Popular Name: 6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methoxy-4-oxo-quinoline-3-carboxylic 6-fluoro-1-[(1R,2S)-2-fluorocycl…
None
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) | -0.02 | 8.36 | -70.15 | 0 | 5 | -1 | 71 | 294.233 | 3 | ↓ |
Lo Low (pH 4.5-6) | -2.45 | 6.62 | -36.96 | 1 | 5 | 0 | 73 | 295.241 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.02 | 6.38 | -16.33 | 1 | 5 | 0 | 69 | 295.241 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US6121285 | IBM Patent Data |