General Information of the Compound
| Compound ID |
CP0577978
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| Compound Name |
N-(3-chloro-4-fluorophenyl)-6-methyl-2-(4-methylimidazol-1-yl)pyrimidin-4-amine
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| Structure |
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| Formula |
C15H13ClFN5
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| Molecular Weight |
317.755
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| Canonical SMILES |
Cc1cn(cn1)-c1nc(C)cc(Nc2ccc(F)c(Cl)c2)n1
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| InChI |
InChI=1S/C15H13ClFN5/c1-9-5-14(20-11-3-4-13(17)12(16)6-11)21-15(19-9)22-7-10(2)18-8-22/h3-8H,1-2H3,(H,19,20,21)
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| InChIKey |
OWEQIMYKBVXMIW-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