General Information of the Compound
Compound ID |
CP0532067
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Compound Name |
4-benzoyl-N-(5-bromo-6-methoxy-1,3-benzothiazol-2-yl)benzamide
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Structure |
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Formula |
C22H15BrN2O3S
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Molecular Weight |
467.344
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Canonical SMILES |
COc1cc2sc(NC(=O)c3ccc(cc3)C(=O)c3ccccc3)nc2cc1Br
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InChI |
InChI=1S/C22H15BrN2O3S/c1-28-18-12-19-17(11-16(18)23)24-22(29-19)25-21(27)15-9-7-14(8-10-15)20(26)13-5-3-2-4-6-13/h2-12H,1H3,(H,24,25,27)
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InChIKey |
DWXRGOPEKBFEDL-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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