| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 26 | No |
| 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) | -0.21 | 1.17 | -31.03 | 4 | 8 | 0 | 124 | 434.59 | 11 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | -0.06 | -59.11 | 3 | 8 | -1 | 131 | 433.582 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[4-[[2-keto-2-(thiazol-2-ylamino)ethyl]thio]butylthio]-N-thiazol-2-yl-acetamide](http://zinc12.docking.org/img/rings/511599.gif)