General Information of the Compound
| Compound ID |
CP0531184
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| Compound Name |
4-(4-fluorobenzyloxy)-1-(4-((propylamino)methyl)benzyloxy)pyridin-2(1H)-one
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| Structure |
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| Formula |
C23H25FN2O3
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| Molecular Weight |
396.462
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| Canonical SMILES |
CCCNCc1ccc(COn2ccc(OCc3ccc(F)cc3)cc2=O)cc1
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| InChI |
InChI=1S/C23H25FN2O3/c1-2-12-25-15-18-3-5-20(6-4-18)17-29-26-13-11-22(14-23(26)27)28-16-19-7-9-21(24)10-8-19/h3-11,13-14,25H,2,12,15-17H2,1H3
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| InChIKey |
YZPSVVRAVSZNGU-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