| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2006 | 6 | No |
Popular Name: 3H-1,2,4-Triazol-3-one 3H-1,2,4-Triazol-3-one
Find On: PubMed — Wikipedia — Google
CAS Number: 42131-33-9
| 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) | -0.99 | -2.77 | -8.72 | 0 | 4 | 0 | 55 | 83.05 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.