General Information of the Compound
| Compound ID |
CP0499690
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| Compound Name |
4-[5-[5-[4-chloro-3-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-3-yl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid
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| Structure |
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| Formula |
C21H15ClF3N3O5
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| Molecular Weight |
481.814
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| Canonical SMILES |
OC(=O)CCC(=O)N1CCc2cc(ccc12)-c1noc(n1)-c1ccc(Cl)c(OC(F)(F)F)c1
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| InChI |
InChI=1S/C21H15ClF3N3O5/c22-14-3-1-13(10-16(14)32-21(23,24)25)20-26-19(27-33-20)12-2-4-15-11(9-12)7-8-28(15)17(29)5-6-18(30)31/h1-4,9-10H,5-8H2,(H,30,31)
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| InChIKey |
FTAQOGGKROFSNT-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