General Information of the Compound
| Compound ID |
CP0518711
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| Compound Name |
4-chloro-1-ethyl-N-(1,3-thiazol-5-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C13H12ClN5OS
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| Molecular Weight |
321.793
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| Canonical SMILES |
CCn1ncc2c(Cl)c(cnc12)C(=O)NCc1cncs1
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| InChI |
InChI=1S/C13H12ClN5OS/c1-2-19-12-9(6-18-19)11(14)10(5-16-12)13(20)17-4-8-3-15-7-21-8/h3,5-7H,2,4H2,1H3,(H,17,20)
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| InChIKey |
OAORNZNPBGBOJS-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