In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 26 | Yes |
Popular Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[(3S)-3-vinylpiperazin-1-yl]quinoline-3-carboxylic 1-cyclopropyl-6-fluoro-4-oxo-7-[…
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) | 0.28 | 10.29 | -100.1 | 2 | 6 | 0 | 82 | 357.385 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.28 | 9.02 | -66.4 | 1 | 6 | -1 | 77 | 356.377 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 8.27 | -54.85 | 3 | 6 | 1 | 79 | 358.393 | 4 | ↓ |
Lo Low (pH 4.5-6) | -2.46 | 8.3 | -83.88 | 3 | 6 | 1 | 85 | 358.393 | 3 | ↓ |