General Information of the Compound
| Compound ID |
CP0902369
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| Compound Name |
3-((6-methyl-2-(pyridin-2-yl)pyrimidin-4-yl)methoxy)benzonitrile
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| Structure |
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| Formula |
C18H14N4O
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| Molecular Weight |
302.337
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| Canonical SMILES |
Cc1cc(COc2cccc(C#N)c2)nc(-c2ccccn2)n1
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| InChI |
InChI=1S/C18H14N4O/c1-13-9-15(12-23-16-6-4-5-14(10-16)11-19)22-18(21-13)17-7-2-3-8-20-17/h2-10H,12H2,1H3
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| InChIKey |
PDGDRQWONJZSGL-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