In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 23 | Yes |
Popular Name: 1-[(1R)-2-(dimethylamino)-1-methyl-ethyl]-4-oxo-5-phenoxy-pyridine-3-carboxylic 1-[(1R)-2-(dimethylamino)-1-meth…
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) | 2.05 | 11.46 | -92.78 | 1 | 6 | 0 | 76 | 316.357 | 6 | ↓ |
Mid Mid (pH 6-8) | -1.23 | 9.39 | -85.76 | 2 | 6 | 1 | 78 | 317.365 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.