In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2006 | 26 | Yes |
Popular Name: 1-butyl-2-hydroxy-4-oxo-N-(3-pyridylmethyl)quinoline-3-carboxamide 1-butyl-2-hydroxy-4-oxo-N-(3-pyr…
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) | 1.57 | 5.33 | -19.45 | 2 | 6 | 0 | 84 | 351.406 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 5.61 | -47.63 | 3 | 6 | 1 | 85 | 352.414 | 6 | ↓ |