General Information of the Compound
Compound ID |
CP0230915
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Compound Name |
1-(Methylsulfonylamino)-3-[2-(4-ethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-2-imidazolidinone
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Structure |
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Formula |
C21H27N3O5S
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Molecular Weight |
433.53
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Canonical SMILES |
CCOc1ccc(CCN2[C@H](CN(NS(C)(=O)=O)C2=O)c2ccc(OC)cc2)cc1
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InChI |
InChI=1S/C21H27N3O5S/c1-4-29-19-9-5-16(6-10-19)13-14-23-20(17-7-11-18(28-2)12-8-17)15-24(21(23)25)22-30(3,26)27/h5-12,20,22H,4,13-15H2,1-3H3/t20-/m1/s1
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InChIKey |
DOXOKPQJRJQUKI-HXUWFJFHSA-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