General Information of the Compound
| Compound ID |
CP0432040
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| Compound Name |
4-(trifluoromethyl)-1,6-dihydroisochromeno[3,4-f]quinolin-2-one
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| Structure |
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| Formula |
C17H10F3NO2
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| Molecular Weight |
317.266
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| Canonical SMILES |
FC(F)(F)c1cc(=O)[nH]c2ccc-3c(OCc4ccccc-34)c12
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| InChI |
InChI=1S/C17H10F3NO2/c18-17(19,20)12-7-14(22)21-13-6-5-11-10-4-2-1-3-9(10)8-23-16(11)15(12)13/h1-7H,8H2,(H,21,22)
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| InChIKey |
HRNRRPMOOJUJLK-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: PT00894, Androgen receptor
Cell-based Assay