General Information of the Compound
| Compound ID |
CP0508853
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| Compound Name |
4-(2-Methyl-thiazol-4-ylethynyl)-pyridine
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| Synonyms |
4-(2-Methyl-thiazol-4-ylethynyl)-pyridine
CHEMBL303090
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| Structure |
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| Formula |
C11H8N2S
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| Molecular Weight |
200.266
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| Canonical SMILES |
Cc1nc(cs1)C#Cc1ccncc1
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| InChI |
InChI=1S/C11H8N2S/c1-9-13-11(8-14-9)3-2-10-4-6-12-7-5-10/h4-8H,1H3
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| InChIKey |
WWKCHJLBBNNNCI-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
Clinical Information about the Compound