General Information of the Compound
| Compound ID |
CP0168607
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| Compound Name |
1-(2-bromophenyl)-5-methyl-N-quinolin-2-ylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C20H15BrN4O
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| Molecular Weight |
407.271
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| Canonical SMILES |
Cc1c(cnn1-c1ccccc1Br)C(=O)Nc1ccc2ccccc2n1
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| InChI |
InChI=1S/C20H15BrN4O/c1-13-15(12-22-25(13)18-9-5-3-7-16(18)21)20(26)24-19-11-10-14-6-2-4-8-17(14)23-19/h2-12H,1H3,(H,23,24,26)
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| InChIKey |
ATYUYECWVYSPBS-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