General Information of the Compound
| Compound ID |
CP0535087
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| Compound Name |
1-(4-((dipropylamino)methyl)phenethyl)-4-(4-fluorobenzyloxy)pyridin-2(1H)-one
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| Structure |
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| Formula |
C27H33FN2O2
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| Molecular Weight |
436.571
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| Canonical SMILES |
CCCN(CCC)Cc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)cc1
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| InChI |
InChI=1S/C27H33FN2O2/c1-3-15-29(16-4-2)20-23-7-5-22(6-8-23)13-17-30-18-14-26(19-27(30)31)32-21-24-9-11-25(28)12-10-24/h5-12,14,18-19H,3-4,13,15-17,20-21H2,1-2H3
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| InChIKey |
FSGMZSPXBSPCRE-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