General Information of the Compound
| Compound ID |
CP0424441
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| Compound Name |
2-[3,5-dibromo-4-[4-methoxy-2-(3-methylbenzoyl)-5-propan-2-ylphenoxy]phenyl]acetic acid
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| Structure |
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| Formula |
C26H24Br2O5
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| Molecular Weight |
576.281
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| Canonical SMILES |
COc1cc(C(=O)c2cccc(C)c2)c(Oc2c(Br)cc(CC(O)=O)cc2Br)cc1C(C)C
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| InChI |
InChI=1S/C26H24Br2O5/c1-14(2)18-12-23(33-26-20(27)9-16(10-21(26)28)11-24(29)30)19(13-22(18)32-4)25(31)17-7-5-6-15(3)8-17/h5-10,12-14H,11H2,1-4H3,(H,29,30)
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| InChIKey |
TZASJPUDKFUECT-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: PT00967, Glucocorticoid receptor
Protein ID: PT00870, Glucocorticoid receptor