General Information of the Compound
Compound ID |
CP0537631
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Compound Name |
N-[1-[(4-fluorophenyl)methyl]-2,3-dihydroindol-5-yl]cyclohexanesulfonamide
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Structure |
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Formula |
C21H25FN2O2S
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Molecular Weight |
388.508
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Canonical SMILES |
Fc1ccc(CN2CCc3cc(NS(=O)(=O)C4CCCCC4)ccc23)cc1
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InChI |
InChI=1S/C21H25FN2O2S/c22-18-8-6-16(7-9-18)15-24-13-12-17-14-19(10-11-21(17)24)23-27(25,26)20-4-2-1-3-5-20/h6-11,14,20,23H,1-5,12-13,15H2
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InChIKey |
XTMXYEVFULFOLR-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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