General Information of the Compound
| Compound ID |
CP0505065
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| Compound Name |
(E)-2-(3-(3-(2-(4-methylbenzoyl)-1H-benzo[d]imidazol-1-yl)prop-1-enyl)phenoxy)acetic acid
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| Structure |
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| Formula |
C26H22N2O4
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| Molecular Weight |
426.472
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| Canonical SMILES |
Cc1ccc(cc1)C(=O)c1nc2ccccc2n1C\C=C\c1cccc(OCC(O)=O)c1
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| InChI |
InChI=1S/C26H22N2O4/c1-18-11-13-20(14-12-18)25(31)26-27-22-9-2-3-10-23(22)28(26)15-5-7-19-6-4-8-21(16-19)32-17-24(29)30/h2-14,16H,15,17H2,1H3,(H,29,30)/b7-5+
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| InChIKey |
NROGDGHZDALZRE-FNORWQNLSA-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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma