| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2008 | 22 | Yes |
Popular Name: 4,6-dimethyl-2-(4-oxo-4-phenyl-butyl)sulfanyl-pyridine-3-carbonitrile 4,6-dimethyl-2-(4-oxo-4-phenyl-b…
| 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) | 3.85 | 10.64 | -13.77 | 0 | 3 | 0 | 54 | 310.422 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.85 | 10.87 | -46.88 | 1 | 3 | 1 | 55 | 311.43 | 6 | ↓ |
