General Information of the Compound
| Compound ID |
CP0455251
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| Compound Name |
5-chloro-1-[(5-chloro-2-cyanophenyl)methyl]-2-iminopyridine-3-carboxamide
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| Structure |
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| Formula |
C14H10Cl2N4O
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| Molecular Weight |
321.167
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| Canonical SMILES |
NC(=O)c1cc(Cl)cn(Cc2cc(Cl)ccc2C#N)c1=N
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| InChI |
InChI=1S/C14H10Cl2N4O/c15-10-2-1-8(5-17)9(3-10)6-20-7-11(16)4-12(13(20)18)14(19)21/h1-4,7,18H,6H2,(H2,19,21)
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| InChIKey |
JWTJHVQMANTACG-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