General Information of the Compound
| Compound ID |
CP0386521
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| Compound Name |
4-[(4-bromoanilino)sulfamoyl]benzoic acid
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| Structure |
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| Formula |
C13H11BrN2O4S
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| Molecular Weight |
371.212
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| Canonical SMILES |
OC(=O)c1ccc(cc1)S(=O)(=O)NNc1ccc(Br)cc1
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| InChI |
InChI=1S/C13H11BrN2O4S/c14-10-3-5-11(6-4-10)15-16-21(19,20)12-7-1-9(2-8-12)13(17)18/h1-8,15-16H,(H,17,18)
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| InChIKey |
XHKFTHFLUUCVDW-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