General Information of the Compound
| Compound ID |
CP0879857
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| Compound Name |
(E,Z)-5-((6-(1-Oxo-1,3-dihydroisobenzofuran-5-yl)-1H-indol-2-yl)methylene)-2-thioxoimidazolidin-4-one
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| Formula |
C20H13N3O3S
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| Molecular Weight |
375.409
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| Canonical SMILES |
O=C1NC(=S)N/C1=C/c1cc2ccc(-c3ccc4c(c3)COC4=O)cc2[nH]1
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| InChI |
InChI=1S/C20H13N3O3S/c24-18-17(22-20(27)23-18)8-14-6-12-2-1-11(7-16(12)21-14)10-3-4-15-13(5-10)9-26-19(15)25/h1-8,21H,9H2,(H2,22,23,24,27)/b17-8+
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| InChIKey |
FADDJNTXJJSSOR-CAOOACKPSA-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