General Information of the Compound
| Compound ID |
CP0472867
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| Compound Name |
6-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
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| Structure |
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| Formula |
C17H13ClN4O
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| Molecular Weight |
324.771
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| Canonical SMILES |
Clc1ccc(cc1)-c1cncc(n1)C(=O)NCc1cccnc1
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| InChI |
InChI=1S/C17H13ClN4O/c18-14-5-3-13(4-6-14)15-10-20-11-16(22-15)17(23)21-9-12-2-1-7-19-8-12/h1-8,10-11H,9H2,(H,21,23)
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| InChIKey |
RTLCJBCGHVLAIU-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