In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 24 | Yes |
Popular Name: 7-chloro-1-cyclopropyl-4-oxo-6-piperazin-1-yl-quinoline-3-carboxylic 7-chloro-1-cyclopropyl-4-oxo-6-p…
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) | 0.79 | 9.72 | -89.8 | 2 | 6 | 0 | 82 | 347.802 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 8.36 | -64.94 | 1 | 6 | -1 | 77 | 346.794 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.65 | 7.94 | -78.25 | 3 | 6 | 1 | 84 | 348.81 | 3 | ↓ |