General Information of the Compound
| Compound ID |
CP0425976
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| Compound Name |
5-[(4-bromophenyl)methoxy]-2-naphthalen-2-yl-1-benzofuran-3-carboxylic acid
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| Structure |
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| Formula |
C26H17BrO4
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| Molecular Weight |
473.322
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| Canonical SMILES |
OC(=O)c1c(oc2ccc(OCc3ccc(Br)cc3)cc12)-c1ccc2ccccc2c1
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| InChI |
InChI=1S/C26H17BrO4/c27-20-9-5-16(6-10-20)15-30-21-11-12-23-22(14-21)24(26(28)29)25(31-23)19-8-7-17-3-1-2-4-18(17)13-19/h1-14H,15H2,(H,28,29)
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| InChIKey |
CYQONFTTWGQMLX-UHFFFAOYSA-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