| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 28 | Yes |
Popular Name: 7-(4-tert-butylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic 7-(4-tert-butylpiperazin-1-yl)-1…
| 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) | 1.08 | 10.55 | -102.52 | 1 | 6 | 0 | 70 | 387.455 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 8.37 | -65.55 | 0 | 6 | -1 | 69 | 386.447 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.66 | 9.6 | -74.34 | 2 | 6 | 1 | 73 | 388.463 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4806539 | IBM Patent Data |
