General Information of the Compound
Compound ID |
CP0490309
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Compound Name |
(E)-1-(4,7-dimethoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one
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Structure |
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Formula |
C19H16O4
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Molecular Weight |
308.333
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Canonical SMILES |
COc1cc(C(=O)\C=C\c2ccccc2)c(OC)c2ccoc12
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InChI |
InChI=1S/C19H16O4/c1-21-17-12-15(18(22-2)14-10-11-23-19(14)17)16(20)9-8-13-6-4-3-5-7-13/h3-12H,1-2H3/b9-8+
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InChIKey |
VSLAMGMSLPXUIL-CMDGGOBGSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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