| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 15 | Yes |
Popular Name: 3-[(1-ethylimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine 3-[(1-ethylimidazol-2-yl)methyls…
| 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) | 0.25 | 5.38 | -12.41 | 3 | 6 | 0 | 85 | 224.293 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 5.86 | -32.92 | 4 | 6 | 1 | 87 | 225.301 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
