| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 20th, 2004 | 21 | Yes |
Popular Name: 4-[3-(Pyridin-3-yl)-(1H)-pyrazol-4-yl]quinoline 4-[3-(Pyridin-3-yl)-(1H)-pyrazol…
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CAS Numbers: 849924-96-5 , [849924-96-5]
| 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) | 2.88 | 6.5 | -10.46 | 1 | 4 | 0 | 54 | 272.311 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.88 | -1.62 | -40.2 | 2 | 4 | 1 | 55 | 273.319 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 113-116(dec) | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.