General Information of the Compound
| Compound ID |
CP0372393
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| Compound Name |
5-(4-(benzyloxy)benzylidene)-3-(4-nitrobenzyl)thiazolidine-2,4-dione
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| Structure |
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| Formula |
C24H18N2O5S
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| Molecular Weight |
446.484
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| Canonical SMILES |
[O-][N+](=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(OCc4ccccc4)cc3)C2=O)cc1
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| InChI |
InChI=1S/C24H18N2O5S/c27-23-22(32-24(28)25(23)15-18-6-10-20(11-7-18)26(29)30)14-17-8-12-21(13-9-17)31-16-19-4-2-1-3-5-19/h1-14H,15-16H2/b22-14-
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| InChIKey |
BOBLHLZIBWNCPR-HMAPJEAMSA-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