General Information of the Compound
| Compound ID |
CP0575254
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| Compound Name |
4-tert-butyl-N-[[2-chloro-4-(cyclopropylsulfonylamino)phenyl]methyl]benzamide
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| Structure |
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| Formula |
C21H25ClN2O3S
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| Molecular Weight |
420.962
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(NS(=O)(=O)C2CC2)cc1Cl
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| InChI |
InChI=1S/C21H25ClN2O3S/c1-21(2,3)16-7-4-14(5-8-16)20(25)23-13-15-6-9-17(12-19(15)22)24-28(26,27)18-10-11-18/h4-9,12,18,24H,10-11,13H2,1-3H3,(H,23,25)
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| InChIKey |
FIZLTMCQFRDCCY-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