General Information of the Compound
| Compound ID |
CP0536698
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| Compound Name |
6-[2-(5-cyanopyridin-3-yl)ethynyl]pyridine-2-carbonitrile
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| Structure |
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| Formula |
C14H6N4
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| Molecular Weight |
230.23
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| Canonical SMILES |
N#Cc1cncc(c1)C#Cc1cccc(n1)C#N
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| InChI |
InChI=1S/C14H6N4/c15-7-12-6-11(9-17-10-12)4-5-13-2-1-3-14(8-16)18-13/h1-3,6,9-10H
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| InChIKey |
UVEUCGSHWPPLCD-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