In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 17 | Yes |
Popular Name: 5-(3-hydroxyphenyl)-6-methyl-2-oxo-1H-pyridine-3-carbonitrile 5-(3-hydroxyphenyl)-6-methyl-2-o…
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) | 1.73 | 3.08 | -16.81 | 2 | 4 | 0 | 77 | 226.235 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 1.07 | -45.56 | 1 | 4 | -1 | 80 | 225.227 | 1 | ↓ |