General Information of the Compound
| Compound ID |
CP0206870
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| Compound Name |
2-[3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(trifluoromethyl)phenyl]-5-fluoroindol-1-yl]acetic acid
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| Structure |
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| Formula |
C23H18F4N2O3
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| Molecular Weight |
446.4
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| Canonical SMILES |
Cc1noc(C)c1Cc1cc(ccc1-c1cn(CC(O)=O)c2ccc(F)cc12)C(F)(F)F
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| InChI |
InChI=1S/C23H18F4N2O3/c1-12-18(13(2)32-28-12)8-14-7-15(23(25,26)27)3-5-17(14)20-10-29(11-22(30)31)21-6-4-16(24)9-19(20)21/h3-7,9-10H,8,11H2,1-2H3,(H,30,31)
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| InChIKey |
VUBZCRNUBWSKIT-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