| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2010 | 20 | Yes |
Popular Name: 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-4,6-dimethyl-pyridine-3-carboxylic 2-[(3,5-dioxo-2H-1,2,4-triazin-6…
| 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) | 1.11 | 0.55 | -102.04 | 1 | 8 | -2 | 135 | 292.276 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.65 | 2.19 | -51.43 | 2 | 8 | -1 | 132 | 293.284 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.65 | 1.8 | -43.8 | 3 | 8 | 0 | 133 | 294.292 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
