General Information of the Compound
| Compound ID |
CP0556327
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| Compound Name |
2,6-difluoro-N-[2-(3-fluorophenyl)-1H-imidazo[4,5-b]pyridin-6-yl]-3-(propylsulfonylamino)benzamide
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| Structure |
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| Formula |
C22H18F3N5O3S
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| Molecular Weight |
489.479
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| Canonical SMILES |
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]c(nc3c2)-c2cccc(F)c2)c1F
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| InChI |
InChI=1S/C22H18F3N5O3S/c1-2-8-34(32,33)30-16-7-6-15(24)18(19(16)25)22(31)27-14-10-17-21(26-11-14)29-20(28-17)12-4-3-5-13(23)9-12/h3-7,9-11,30H,2,8H2,1H3,(H,27,31)(H,26,28,29)
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| InChIKey |
ZBKPMNHXDDQISP-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