General Information of the Compound
| Compound ID |
CP0383205
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| Compound Name |
5-(3-Bromo-phenyl)-6-(4-fluoro-phenyl)-7-(6-morpholin-4-yl-pyridin-3-yl)-pyrido[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C28H22BrFN6O
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| Molecular Weight |
557.427
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| Canonical SMILES |
Nc1ncnc2nc(-c3ccc(nc3)N3CCOCC3)c(-c3ccc(F)cc3)c(-c3cccc(Br)c3)c12
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| InChI |
InChI=1S/C28H22BrFN6O/c29-20-3-1-2-18(14-20)23-24(17-4-7-21(30)8-5-17)26(35-28-25(23)27(31)33-16-34-28)19-6-9-22(32-15-19)36-10-12-37-13-11-36/h1-9,14-16H,10-13H2,(H2,31,33,34,35)
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| InChIKey |
HSYOVYMEIHEOMC-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