In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 27 | Yes |
Popular Name: 1-tert-butyl-7-(2,6-dimethyl-4-pyridyl)-6-fluoro-4-oxo-quinoline-3-carboxylic 1-tert-butyl-7-(2,6-dimethyl-4-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) | 2.11 | 10.77 | -67.05 | 0 | 5 | -1 | 75 | 367.4 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 9.88 | -29.95 | 1 | 5 | 0 | 78 | 368.408 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 11.15 | -94.28 | 1 | 5 | 0 | 76 | 368.408 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 10.26 | -68.04 | 2 | 5 | 1 | 79 | 369.416 | 3 | ↓ |