| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 17 | Yes |
Popular Name: 6-[(6-methyl-3-pyridyl)methylamino]-2H-1,2,4-triazine-3,5-dione 6-[(6-methyl-3-pyridyl)methylami…
| 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) | -1.02 | -0.11 | -8.55 | 3 | 7 | 0 | 104 | 233.231 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.56 | -1.79 | -37.44 | 2 | 7 | -1 | 107 | 232.223 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.02 | 0.32 | -38.44 | 4 | 7 | 1 | 105 | 234.239 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
