| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2007 | 13 | Yes |
Popular Name: 6-(1H-Pyrazol-1-yl)nicotinonitrile 6-(1H-Pyrazol-1-yl)nicotinonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 956568-52-8 , [956568-52-8]
| 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) | 0.94 | 5.4 | -7.78 | 0 | 4 | 0 | 55 | 170.175 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.94 | 5.66 | -40.88 | 1 | 4 | 1 | 56 | 171.183 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
