General Information of the Compound
Compound ID |
CP0461834
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Compound Name |
6-[(1,4-dimethylpyrazol-3-yl)amino]-4-(5-methylpyridin-3-yl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
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Structure |
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Formula |
C19H17N7
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Molecular Weight |
343.394
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Canonical SMILES |
Cc1cn(C)nc1Nc1cc(-c2cncc(C)c2)c2c(c[nH]c2n1)C#N
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InChI |
InChI=1S/C19H17N7/c1-11-4-13(8-21-7-11)15-5-16(23-18-12(2)10-26(3)25-18)24-19-17(15)14(6-20)9-22-19/h4-5,7-10H,1-3H3,(H2,22,23,24,25)
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InChIKey |
NALYLVDIOYIJLQ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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