General Information of the Compound
| Compound ID |
CP0441763
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| Compound Name |
1-(7-(4-tert-butylbenzyloxy)-6-hydroxy-4-methoxybenzofuran-5-yl)ethanone
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| Structure |
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| Formula |
C22H24O5
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| Molecular Weight |
368.429
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| Canonical SMILES |
COc1c(C(C)=O)c(O)c(OCc2ccc(cc2)C(C)(C)C)c2occc12
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| InChI |
InChI=1S/C22H24O5/c1-13(23)17-18(24)21(20-16(10-11-26-20)19(17)25-5)27-12-14-6-8-15(9-7-14)22(2,3)4/h6-11,24H,12H2,1-5H3
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| InChIKey |
ODTOFSSMIUYEDR-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