General Information of the Compound
| Compound ID |
CP0535088
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| Compound Name |
4-(4-fluorobenzyloxy)-1-(4-(((2-fluoroethyl)(propyl)amino)methyl)phenethyl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C26H30F2N2O2
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| Molecular Weight |
440.534
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| Canonical SMILES |
CCCN(CCF)Cc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)cc1
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| InChI |
InChI=1S/C26H30F2N2O2/c1-2-14-29(17-13-27)19-22-5-3-21(4-6-22)11-15-30-16-12-25(18-26(30)31)32-20-23-7-9-24(28)10-8-23/h3-10,12,16,18H,2,11,13-15,17,19-20H2,1H3
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| InChIKey |
NFSDJUMTRUEHPP-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