General Information of the Compound
| Compound ID |
CP0220860
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| Compound Name |
3-[5-[5-(cyclopropanecarbonyl)-2-fluorophenyl]-1-benzofuran-2-yl]propanoic acid
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| Structure |
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| Formula |
C21H17FO4
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| Molecular Weight |
352.361
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| Canonical SMILES |
OC(=O)CCc1cc2cc(ccc2o1)-c1cc(ccc1F)C(=O)C1CC1
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| InChI |
InChI=1S/C21H17FO4/c22-18-6-3-14(21(25)12-1-2-12)11-17(18)13-4-7-19-15(9-13)10-16(26-19)5-8-20(23)24/h3-4,6-7,9-12H,1-2,5,8H2,(H,23,24)
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| InChIKey |
ZBFAQUJBQJNPBX-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
Protein ID: PT03121, Free fatty acid receptor 4
Protein ID: PT04427, Free fatty acid receptor 4