| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 26 | Yes |
Popular Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic 6-fluoro-1-(2-fluoroethyl)-8-met…
| 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) | -0.78 | 8.08 | -99.41 | 2 | 7 | 0 | 91 | 367.352 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.78 | 6.95 | -59.45 | 1 | 7 | -1 | 87 | 366.344 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.78 | 6.06 | -57.99 | 3 | 7 | 1 | 88 | 368.36 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -3.53 | 6.61 | -80.04 | 3 | 7 | 1 | 94 | 368.36 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4997943 | IBM Patent Data |
