General Information of the Compound
| Compound ID |
CP0238279
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| Compound Name |
2-phenyl-5-(1H-pyrazol-3-yl)-1,3-thiazole
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| Structure |
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| Formula |
C12H9N3S
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| Molecular Weight |
227.292
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| Canonical SMILES |
c1cc(n[nH]1)-c1cnc(s1)-c1ccccc1
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| InChI |
InChI=1S/C12H9N3S/c1-2-4-9(5-3-1)12-13-8-11(16-12)10-6-7-14-15-10/h1-8H,(H,14,15)
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| InChIKey |
NRAHRUHGPGBWSI-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound