General Information of the Compound
| Compound ID |
CP0372666
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| Compound Name |
(E)-2-(4-(Cyclohexyl(((4-methyl-2-(4-(trifluoromethyl)-phenyl)thiazol-5-yl)methoxy)imino)methyl)phenoxy)acetic acid
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| Structure |
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| Formula |
C28H29F3N2O4S
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| Molecular Weight |
546.611
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| Canonical SMILES |
Cc1nc(sc1CO\N=C(/C1CCCCC1)c1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C28H29F3N2O4S/c1-17-14-21(10-13-23(17)36-16-25(34)35)26(19-6-4-3-5-7-19)33-37-15-24-18(2)32-27(38-24)20-8-11-22(12-9-20)28(29,30)31/h8-14,19H,3-7,15-16H2,1-2H3,(H,34,35)/b33-26+
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| InChIKey |
RYEAHDYVEBVUFB-MHTZHOPKSA-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