General Information of the Compound
| Compound ID |
CP0507700
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| Compound Name |
2-(4-chlorophenyl)-3-methyl-N-pyrazin-2-ylbutanamide
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| Structure |
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| Formula |
C15H16ClN3O
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| Molecular Weight |
289.766
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| Canonical SMILES |
CC(C)C(C(=O)Nc1cnccn1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C15H16ClN3O/c1-10(2)14(11-3-5-12(16)6-4-11)15(20)19-13-9-17-7-8-18-13/h3-10,14H,1-2H3,(H,18,19,20)
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| InChIKey |
TZUSFIDGTUCEET-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