| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 14 | No |
Popular Name: 5-(4,5-dibromo-2-thienyl)-4-methyl-1,2,4-triazole-3-thiolate 5-(4,5-dibromo-2-thienyl)-4-meth…
| 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) | 3.74 | 7.28 | -38.41 | 0 | 3 | -1 | 31 | 354.072 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 7.17 | -8.27 | 1 | 3 | 0 | 34 | 355.08 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
