General Information of the Compound
| Compound ID |
CP0852234
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| Compound Name |
(E,Z)-5-((5-(1-Oxo-1,3-dihydroisobenzofuran-5-yl)benzo[b]thiophen-2-yl)methylene)-2-thioxoimidazolidin-4-one
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| Structure |
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| Formula |
C20H12N2O3S2
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| Molecular Weight |
392.461
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| Canonical SMILES |
O=C1NC(=S)N/C1=C/c1cc2cc(-c3ccc4c(c3)COC4=O)ccc2s1
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| InChI |
InChI=1S/C20H12N2O3S2/c23-18-16(21-20(26)22-18)8-14-7-12-5-11(2-4-17(12)27-14)10-1-3-15-13(6-10)9-25-19(15)24/h1-8H,9H2,(H2,21,22,23,26)/b16-8+
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| InChIKey |
IMDJEWJYMDXIRU-LZYBPNLTSA-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