| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 23 | Yes |
Popular Name: N-[3-(diethylamino)propyl]-5-oxo-1-phenyl-4H-1,2,4-triazole-3-carboxamide N-[3-(diethylamino)propyl]-5-oxo…
| 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) | 0.73 | 6.35 | -45.91 | 3 | 7 | 1 | 84 | 318.401 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 4.49 | -64.66 | 2 | 7 | 0 | 87 | 317.393 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
