General Information of the Compound
| Compound ID |
CP0547280
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| Compound Name |
8-(4-chlorophenyl)-6-quinolin-6-yl-2-(2,2,2-trifluoroethylamino)pyrido[4,3-d]pyrimidin-7-one
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| Structure |
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| Formula |
C24H15ClF3N5O
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| Molecular Weight |
481.865
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| Canonical SMILES |
FC(F)(F)CNc1ncc2cn(-c3ccc4ncccc4c3)c(=O)c(-c3ccc(Cl)cc3)c2n1
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| InChI |
InChI=1S/C24H15ClF3N5O/c25-17-5-3-14(4-6-17)20-21-16(11-30-23(32-21)31-13-24(26,27)28)12-33(22(20)34)18-7-8-19-15(10-18)2-1-9-29-19/h1-12H,13H2,(H,31,32)
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| InChIKey |
HEYUVJFLGRWFDO-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