General Information of the Compound
| Compound ID |
CP0278453
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| Compound Name |
2-(6-(3-(4-(4-fluorobenzoyl)-2-propylphenoxy)propoxy)-1H-indol-1-yl)acetic acid
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| Structure |
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| Formula |
C29H28FNO5
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| Molecular Weight |
489.543
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| Canonical SMILES |
CCCc1cc(ccc1OCCCOc1ccc2ccn(CC(O)=O)c2c1)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C29H28FNO5/c1-2-4-22-17-23(29(34)21-5-9-24(30)10-6-21)8-12-27(22)36-16-3-15-35-25-11-7-20-13-14-31(19-28(32)33)26(20)18-25/h5-14,17-18H,2-4,15-16,19H2,1H3,(H,32,33)
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| InChIKey |
CHUOXAKJPAYADI-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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00909, Peroxisome proliferator-activated receptor delta
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma