General Information of the Compound
| Compound ID |
CP0212793
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| Compound Name |
5-[[4-[(3-bromophenyl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
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| Structure |
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| Formula |
C17H14BrNO3S
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| Molecular Weight |
392.274
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| Canonical SMILES |
Brc1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
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| InChI |
InChI=1S/C17H14BrNO3S/c18-13-3-1-2-12(8-13)10-22-14-6-4-11(5-7-14)9-15-16(20)19-17(21)23-15/h1-8,15H,9-10H2,(H,19,20,21)
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| InChIKey |
REXWEDIBMQCBQS-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