| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 15 | No |
Popular Name: 4-[4-(dimethylamino)butyl]-5-ethyl-1,2,4-triazole-3-thiol 4-[4-(dimethylamino)butyl]-5-eth…
| 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) | 0.68 | 8.52 | -47.24 | 2 | 4 | 1 | 38 | 229.373 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 8.42 | -64.62 | 1 | 4 | 0 | 35 | 228.365 | 6 | ↓ |
