| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 18 | Yes |
Popular Name: N-isopropyl-5-oxo-1-phenyl-4H-1,2,4-triazole-3-carboxamide N-isopropyl-5-oxo-1-phenyl-4H-1,…
| 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) | 0.35 | 3.72 | -9.04 | 2 | 6 | 0 | 80 | 246.27 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | 1.88 | -48.23 | 1 | 6 | -1 | 83 | 245.262 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
