General Information of the Compound
| Compound ID |
CP0502757
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| Compound Name |
4-(4-fluorobenzyloxy)-1-(3-(3-(pyrrolidin-1-yl)propoxy)benzyl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C26H29FN2O3
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| Molecular Weight |
436.527
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| Canonical SMILES |
Fc1ccc(COc2ccn(Cc3cccc(OCCCN4CCCC4)c3)c(=O)c2)cc1
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| InChI |
InChI=1S/C26H29FN2O3/c27-23-9-7-21(8-10-23)20-32-25-11-15-29(26(30)18-25)19-22-5-3-6-24(17-22)31-16-4-14-28-12-1-2-13-28/h3,5-11,15,17-18H,1-2,4,12-14,16,19-20H2
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| InChIKey |
GEFGDHCYHBZWCS-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