| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 20 | Yes |
Popular Name: 5-[(1S)-cyclohexa-2,4-dien-1-yl]-2-(2,4-dibromophenyl)-1,2,4-triazol-2-ium-3-one 5-[(1S)-cyclohexa-2,4-dien-1-yl]…
| 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) | -0.17 | 8.18 | -22.87 | 0 | 4 | 1 | 47 | 396.062 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
