General Information of the Compound
| Compound ID |
CP0549530
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| Compound Name |
N-[[2-chloro-4-(methanesulfonamido)phenyl]methyl]-4-propan-2-yloxybenzamide
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| Structure |
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| Formula |
C18H21ClN2O4S
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| Molecular Weight |
396.896
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| Canonical SMILES |
CC(C)Oc1ccc(cc1)C(=O)NCc1ccc(NS(C)(=O)=O)cc1Cl
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| InChI |
InChI=1S/C18H21ClN2O4S/c1-12(2)25-16-8-5-13(6-9-16)18(22)20-11-14-4-7-15(10-17(14)19)21-26(3,23)24/h4-10,12,21H,11H2,1-3H3,(H,20,22)
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| InChIKey |
MPKALXYEQPVWJT-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