General Information of the Compound
| Compound ID |
CP0416316
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| Compound Name |
(Z)-2-(Benzylidene)-4-(cyclohexylmethoxy)benzofuran-3(2H)-one
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| Structure |
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| Formula |
C22H22O3
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| Molecular Weight |
334.415
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| Canonical SMILES |
O=C1\C(Oc2cccc(OCC3CCCCC3)c12)=C\c1ccccc1
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| InChI |
InChI=1S/C22H22O3/c23-22-20(14-16-8-3-1-4-9-16)25-19-13-7-12-18(21(19)22)24-15-17-10-5-2-6-11-17/h1,3-4,7-9,12-14,17H,2,5-6,10-11,15H2/b20-14-
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| InChIKey |
WMZJLTHKGDQXGT-ZHZULCJRSA-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