General Information of the Compound
| Compound ID |
CP0579431
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| Compound Name |
N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-7-[2-(2-fluoroethoxy)phenyl]-1-benzofuran-2-carboxamide
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| Structure |
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| Formula |
C24H24ClFN2O3
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| Molecular Weight |
442.918
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| Canonical SMILES |
FCCOc1ccccc1-c1cc(Cl)cc2cc(oc12)C(=O)NC1CN2CCC1CC2
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| InChI |
InChI=1S/C24H24ClFN2O3/c25-17-11-16-12-22(24(29)27-20-14-28-8-5-15(20)6-9-28)31-23(16)19(13-17)18-3-1-2-4-21(18)30-10-7-26/h1-4,11-13,15,20H,5-10,14H2,(H,27,29)
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| InChIKey |
KBGOFGITDNESDT-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