| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 20 | Yes |
Popular Name: N-[4-cyano-3-(cyanomethyl)-1H-pyrazol-5-yl]-4-methyl-2-oxo-3H-thiazole-5-carboxamide N-[4-cyano-3-(cyanomethyl)-1H-py…
| 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) | 0.06 | 2.16 | -14.46 | 3 | 8 | 0 | 138 | 288.292 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.06 | 2.02 | -37.23 | 2 | 8 | -1 | 137 | 287.284 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
