| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 15 | No |
Popular Name: 5-methyl-4-[(5-methylpyrazin-2-yl)methyl]-1,2,4-triazole-3-thiol 5-methyl-4-[(5-methylpyrazin-2-y…
| 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) | -0.12 | 4.74 | -18.01 | 1 | 5 | 0 | 59 | 221.289 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 4.87 | -52.77 | 0 | 5 | -1 | 57 | 220.281 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
