| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: 5-Methyl-2-(pyridin-2-yl)thiazol-4-ol 5-Methyl-2-(pyridin-2-yl)thiazol…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 131786-47-5 , [131786-47-5]
| 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) | 1.77 | 0.28 | -9.22 | 1 | 3 | 0 | 46 | 192.243 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 235-238° | Matrix Scientific |
| melting_point | 236 - 238 | KeyOrganics |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| LOX5-1-E | Arachidonate 5-lipoxygenase (cluster #1 Of 6), Eukaryotic | Eukaryotes | 2100 | 0.61 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| LOX5_RAT | P12527 | Arachidonate 5-lipoxygenase, Rat | 2100 | 0.61 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.