General Information of the Compound
| Compound ID |
CP0901266
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| Compound Name |
[5-(2-Fluoro-benzyl)-2-pyridin-2-yl-pyrimidin-4-yl]-methyl-amine
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| Structure |
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| Formula |
C17H15FN4
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| Molecular Weight |
294.333
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| Canonical SMILES |
CNc1nc(-c2ccccn2)ncc1Cc1ccccc1F
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| InChI |
InChI=1S/C17H15FN4/c1-19-16-13(10-12-6-2-3-7-14(12)18)11-21-17(22-16)15-8-4-5-9-20-15/h2-9,11H,10H2,1H3,(H,19,21,22)
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| InChIKey |
VEULGBDBABMJHS-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