In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2010 | 25 | Yes |
Popular Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-tert-butyl-6-fluoro-4-oxo-quinoline-3-carboxylic 7-(3-amino-3-methyl-azetidin-1-y…
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) | 0.53 | 7.89 | -116.34 | 3 | 6 | 0 | 93 | 347.39 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 7.52 | -66.18 | 2 | 6 | -1 | 91 | 346.382 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.53 | 5.89 | -69.81 | 4 | 6 | 1 | 90 | 348.398 | 3 | ↓ |
Lo Low (pH 4.5-6) | -2.22 | 6.06 | -89.09 | 4 | 6 | 1 | 96 | 348.398 | 2 | ↓ |