General Information of the Compound
| Compound ID |
CP0493388
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| Compound Name |
(R)-2-(4'-Chloro-biphenyl-4-ylmethoxy)-pentanoic acid
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| Structure |
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| Formula |
C18H19ClO3
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| Molecular Weight |
318.8
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| Canonical SMILES |
CCC[C@@H](OCc1ccc(cc1)-c1ccc(Cl)cc1)C(O)=O
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| InChI |
InChI=1S/C18H19ClO3/c1-2-3-17(18(20)21)22-12-13-4-6-14(7-5-13)15-8-10-16(19)11-9-15/h4-11,17H,2-3,12H2,1H3,(H,20,21)/t17-/m1/s1
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| InChIKey |
DXAZLKAOWFRAEW-QGZVFWFLSA-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