| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 23 | Yes |
Popular Name: 5-oxo-1-phenyl-N-(1,1,3,3-tetramethylbutyl)-4H-1,2,4-triazole-3-carboxamide 5-oxo-1-phenyl-N-(1,1,3,3-tetram…
| 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) | 2.46 | 7.39 | -8.03 | 2 | 6 | 0 | 80 | 316.405 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 5.54 | -49.3 | 1 | 6 | -1 | 83 | 315.397 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
