General Information of the Compound
| Compound ID |
CP0384228
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| Compound Name |
2-(2-((5-(4-(Trifluoromethyl)phenyl)-4-(4-methoxyphenyl)-thiazol-2-yl)methoxy)naphthalen-5-yl)acetic Acid
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| Structure |
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| Formula |
C30H22F3NO4S
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| Molecular Weight |
549.57
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(COc2ccc3c(CC(O)=O)cccc3c2)sc1-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C30H22F3NO4S/c1-37-23-11-7-18(8-12-23)28-29(19-5-9-22(10-6-19)30(31,32)33)39-26(34-28)17-38-24-13-14-25-20(15-24)3-2-4-21(25)16-27(35)36/h2-15H,16-17H2,1H3,(H,35,36)
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| InChIKey |
UXNAHMSBHUHRKW-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