General Information of the Compound
| Compound ID |
CP0865156
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| Compound Name |
5-(5-((1H-indol-4-yl)methoxy)-2-bromo-4-hydroxybenzylidene)-3-methylthiazolidine-2,4-dione
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| Structure |
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| Formula |
C20H15BrN2O4S
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| Molecular Weight |
459.321
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| Canonical SMILES |
CN1C(=O)S/C(=C\c2cc(OCc3cccc4[nH]ccc34)c(O)cc2Br)C1=O
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| InChI |
InChI=1S/C20H15BrN2O4S/c1-23-19(25)18(28-20(23)26)8-12-7-17(16(24)9-14(12)21)27-10-11-3-2-4-15-13(11)5-6-22-15/h2-9,22,24H,10H2,1H3/b18-8-
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| InChIKey |
STTCAXGJSBVFDP-LSCVHKIXSA-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