General Information of the Compound
| Compound ID |
CP0543025
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| Compound Name |
2-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]pyridine-4-carbonitrile
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| Structure |
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| Formula |
C14H11N5S2
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| Molecular Weight |
313.411
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| Canonical SMILES |
Cc1nc(C)c(s1)-c1csc(Nc2cc(ccn2)C#N)n1
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| InChI |
InChI=1S/C14H11N5S2/c1-8-13(21-9(2)17-8)11-7-20-14(18-11)19-12-5-10(6-15)3-4-16-12/h3-5,7H,1-2H3,(H,16,18,19)
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| InChIKey |
XLWUFUYBUPYRLN-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