| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 17 | No |
Popular Name: 4-amino-5-(2,3-dihydro-1,4-benzodioxin-8-yl)-1,2,4-triazole-3-thiol 4-amino-5-(2,3-dihydro-1,4-benzo…
| 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) | 1.36 | 4.59 | -46.75 | 2 | 6 | -1 | 75 | 249.275 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 4.56 | -11.95 | 3 | 6 | 0 | 78 | 250.283 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
