General Information of the Compound
| Compound ID |
CP0143129
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| Compound Name |
1-(6-aminopyrimidin-4-yl)pyrrolo[2,3-b]pyridine-6-carbonitrile
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| Structure |
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| Formula |
C12H8N6
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| Molecular Weight |
236.238
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| Canonical SMILES |
Nc1cc(ncn1)-n1ccc2ccc(nc12)C#N
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| InChI |
InChI=1S/C12H8N6/c13-6-9-2-1-8-3-4-18(12(8)17-9)11-5-10(14)15-7-16-11/h1-5,7H,(H2,14,15,16)
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| InChIKey |
WKZNRECKZVYTNT-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