General Information of the Compound
| Compound ID |
CP0498941
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| Compound Name |
N-methyl-6-(2-phenylethynyl)pyridine-3-carboxamide
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| Structure |
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| Formula |
C15H12N2O
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| Molecular Weight |
236.274
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| Canonical SMILES |
CNC(=O)c1ccc(nc1)C#Cc1ccccc1
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| InChI |
InChI=1S/C15H12N2O/c1-16-15(18)13-8-10-14(17-11-13)9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,1H3,(H,16,18)
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| InChIKey |
WVNGKXQNDMJTSH-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