General Information of the Compound
| Compound ID |
CP0491220
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| Compound Name |
4-(4-fluorobenzyloxy)-1-(4-((methyl(propyl)amino)methyl)phenethyl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C25H29FN2O2
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| Molecular Weight |
408.517
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| Canonical SMILES |
CCCN(C)Cc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)cc1
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| InChI |
InChI=1S/C25H29FN2O2/c1-3-14-27(2)18-21-6-4-20(5-7-21)12-15-28-16-13-24(17-25(28)29)30-19-22-8-10-23(26)11-9-22/h4-11,13,16-17H,3,12,14-15,18-19H2,1-2H3
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| InChIKey |
OCWYCPGJMYIAHR-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