General Information of the Compound
| Compound ID |
CP0858019
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| Compound Name |
4-bromo-N-(4-chloro-2-(pyridine-4-carbonyl)phenyl)benzenesulfonamide
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| Structure |
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| Formula |
C18H12BrClN2O3S
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| Molecular Weight |
451.729
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| Canonical SMILES |
O=C(c1ccncc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(Br)cc1
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| InChI |
InChI=1S/C18H12BrClN2O3S/c19-13-1-4-15(5-2-13)26(24,25)22-17-6-3-14(20)11-16(17)18(23)12-7-9-21-10-8-12/h1-11,22H
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| InChIKey |
NEMWBDKWYAQBHE-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