General Information of the Compound
| Compound ID |
CP0431457
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| Compound Name |
5,6-Bis-(3-fluoro-4-methyl-phenyl)-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C25H18F2N4S
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| Molecular Weight |
444.51
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| Canonical SMILES |
Cc1ccc(cc1F)-c1c(nc2ncnc(N)c2c1-c1ccc(C)c(F)c1)-c1cccs1
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| InChI |
InChI=1S/C25H18F2N4S/c1-13-5-7-15(10-17(13)26)20-21(16-8-6-14(2)18(27)11-16)23(19-4-3-9-32-19)31-25-22(20)24(28)29-12-30-25/h3-12H,1-2H3,(H2,28,29,30,31)
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| InChIKey |
SGKWBFDQCJDIDV-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