General Information of the Compound
| Compound ID |
CP0278338
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| Compound Name |
N-[[3-[[3-[(5-chlorothiophen-2-yl)sulfonylamino]-4-(difluoromethyl)indazol-1-yl]methyl]phenyl]methyl]acetamide
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| Structure |
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| Formula |
C22H19ClF2N4O3S2
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| Molecular Weight |
525.002
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| Canonical SMILES |
CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(cccc23)C(F)F)c1
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| InChI |
InChI=1S/C22H19ClF2N4O3S2/c1-13(30)26-11-14-4-2-5-15(10-14)12-29-17-7-3-6-16(21(24)25)20(17)22(27-29)28-34(31,32)19-9-8-18(23)33-19/h2-10,21H,11-12H2,1H3,(H,26,30)(H,27,28)
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| InChIKey |
FWDBCHHWAWMCFJ-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