General Information of the Compound
| Compound ID |
CP0442343
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| Compound Name |
(2Z)-2-[[1-[(3-bromophenyl)methyl]indol-3-yl]methylidene]-4,6-dihydroxy-1-benzofuran-3-one
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| Structure |
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| Formula |
C24H16BrNO4
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| Molecular Weight |
462.299
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| Canonical SMILES |
Oc1cc2O\C(=C/c3cn(Cc4cccc(Br)c4)c4ccccc34)C(=O)c2c(O)c1
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| InChI |
InChI=1S/C24H16BrNO4/c25-16-5-3-4-14(8-16)12-26-13-15(18-6-1-2-7-19(18)26)9-22-24(29)23-20(28)10-17(27)11-21(23)30-22/h1-11,13,27-28H,12H2/b22-9-
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| InChIKey |
XWBBJOPVEPACOL-AFPJDJCSSA-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