General Information of the Compound
Compound ID |
CP0862322
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Compound Name |
N-[4-Chloro-2-(pyridine4-carbonyl)-phenyl]-3-fluoro-4-morpholin4-yl-benzenesulfonamide
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Structure |
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Formula |
C22H19ClFN3O4S
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Molecular Weight |
475.929
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Canonical SMILES |
O=C(c1ccncc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(N2CCOCC2)c(F)c1
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InChI |
InChI=1S/C22H19ClFN3O4S/c23-16-1-3-20(18(13-16)22(28)15-5-7-25-8-6-15)26-32(29,30)17-2-4-21(19(24)14-17)27-9-11-31-12-10-27/h1-8,13-14,26H,9-12H2
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InChIKey |
AUCCSTCHDWDFTJ-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