| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 22nd, 2008 | 32 | Yes |
Popular Name: ethyl ethyl
| 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) | 3.63 | -1.85 | -14.2 | 2 | 8 | 0 | 114 | 470.576 | 8 | ↓ |
| Ref Reference (pH 7) | 4.09 | 7.72 | -49.47 | 1 | 8 | -1 | 117 | 469.568 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.63 | 8.94 | -16.26 | 2 | 8 | 0 | 114 | 470.576 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(5-keto-6-phenyl-4H-1,2,4-triazin-3-yl)thio]-N-(4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide](http://zinc12.docking.org/img/rings/66226.gif)