General Information of the Compound
| Compound ID |
CP0919192
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| Compound Name |
(E,Z)-5-((4-(1-Oxo-1,3-dihydroisobenzofuran-5-yl)thiophen-2-yl)methylene)-2-thioxoimidazolidin-4-one
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| Structure |
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| Formula |
C16H10N2O3S2
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| Molecular Weight |
342.401
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| Canonical SMILES |
O=C1NC(=S)N/C1=C/c1cc(-c2ccc3c(c2)COC3=O)cs1
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| InChI |
InChI=1S/C16H10N2O3S2/c19-14-13(17-16(22)18-14)5-11-4-10(7-23-11)8-1-2-12-9(3-8)6-21-15(12)20/h1-5,7H,6H2,(H2,17,18,19,22)/b13-5+
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| InChIKey |
CMOYHYQEGSOTRT-WLRTZDKTSA-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