General Information of the Compound
| Compound ID |
CP0131377
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| Compound Name |
1-(2-aminopyrimidin-4-yl)indole-6-carbonitrile
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| Structure |
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| Formula |
C13H9N5
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| Molecular Weight |
235.25
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| Canonical SMILES |
Nc1nccc(n1)-n1ccc2ccc(cc12)C#N
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| InChI |
InChI=1S/C13H9N5/c14-8-9-1-2-10-4-6-18(11(10)7-9)12-3-5-16-13(15)17-12/h1-7H,(H2,15,16,17)
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| InChIKey |
BDYPUORSRWNQAZ-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