| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 16 | Yes |
Popular Name: 3-[2-(1-aminocyclobutyl)-1H-imidazol-4-yl]-1,4-dihydro-1,2,4-triazol-5-one 3-[2-(1-aminocyclobutyl)-1H-imid…
None
| 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) | -0.76 | -1.06 | -59.03 | 6 | 7 | 1 | 118 | 221.244 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | -3.96 | -52.18 | 4 | 7 | -1 | 119 | 219.228 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | -3.66 | -87.06 | 5 | 7 | 0 | 121 | 220.236 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
