General Information of the Compound
| Compound ID |
CP0569401
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| Compound Name |
5-chloro-4-pyrrolo[3,2-b]pyridin-1-ylpyrimidine-2-carbonitrile
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| Structure |
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| Formula |
C12H6ClN5
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| Molecular Weight |
255.668
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| Canonical SMILES |
Clc1cnc(nc1-n1ccc2ncccc12)C#N
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| InChI |
InChI=1S/C12H6ClN5/c13-8-7-16-11(6-14)17-12(8)18-5-3-9-10(18)2-1-4-15-9/h1-5,7H
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| InChIKey |
ZUJLFEDYDAWUGY-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