General Information of the Compound
| Compound ID |
CP0438818
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| Compound Name |
methyl 4-[(Z)-[4-(cyclohexylmethoxy)-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate
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| Structure |
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| Formula |
C24H24O5
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| Molecular Weight |
392.451
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| Canonical SMILES |
COC(=O)c1ccc(\C=C2/Oc3cccc(OCC4CCCCC4)c3C2=O)cc1
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| InChI |
InChI=1S/C24H24O5/c1-27-24(26)18-12-10-16(11-13-18)14-21-23(25)22-19(8-5-9-20(22)29-21)28-15-17-6-3-2-4-7-17/h5,8-14,17H,2-4,6-7,15H2,1H3/b21-14-
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| InChIKey |
WRXZDQVDLJAPCD-STZFKDTASA-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