General Information of the Compound
| Compound ID |
CP0416317
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| Compound Name |
(Z)-2-(4-Chlorobenzylidene)-4-(cyclohexylmethoxy)benzofuran-3(2H)-one
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| Structure |
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| Formula |
C22H21ClO3
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| Molecular Weight |
368.86
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| Canonical SMILES |
Clc1ccc(\C=C2/Oc3cccc(OCC4CCCCC4)c3C2=O)cc1
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| InChI |
InChI=1S/C22H21ClO3/c23-17-11-9-15(10-12-17)13-20-22(24)21-18(7-4-8-19(21)26-20)25-14-16-5-2-1-3-6-16/h4,7-13,16H,1-3,5-6,14H2/b20-13-
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| InChIKey |
SEXKPRFPXSINEL-MOSHPQCFSA-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