General Information of the Compound
| Compound ID |
CP0556979
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| Compound Name |
6-cyclopropyl-2-(4,4-difluoroazepan-1-yl)-N-(2-sulfamoylpyridin-4-yl)pyridine-3-carboxamide
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| Structure |
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| Formula |
C20H23F2N5O3S
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| Molecular Weight |
451.499
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| Canonical SMILES |
NS(=O)(=O)c1cc(NC(=O)c2ccc(nc2N2CCCC(F)(F)CC2)C2CC2)ccn1
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| InChI |
InChI=1S/C20H23F2N5O3S/c21-20(22)7-1-10-27(11-8-20)18-15(4-5-16(26-18)13-2-3-13)19(28)25-14-6-9-24-17(12-14)31(23,29)30/h4-6,9,12-13H,1-3,7-8,10-11H2,(H2,23,29,30)(H,24,25,28)
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| InChIKey |
SKNGBHHNRLIRMP-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