General Information of the Compound
| Compound ID |
CP0486095
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| Compound Name |
methyl 4-bromo-2-[(4-oxochromene-2-carbonyl)amino]benzoate
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| Formula |
C18H12BrNO5
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| Molecular Weight |
402.2
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| Canonical SMILES |
COC(=O)c1ccc(Br)cc1NC(=O)c1cc(=O)c2ccccc2o1
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| InChI |
InChI=1S/C18H12BrNO5/c1-24-18(23)11-7-6-10(19)8-13(11)20-17(22)16-9-14(21)12-4-2-3-5-15(12)25-16/h2-9H,1H3,(H,20,22)
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| InChIKey |
ILMMPTNONXIIHA-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