General Information of the Compound
| Compound ID |
CP0579374
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| Compound Name |
N-(1-azabicyclo[2.2.2]octan-3-yl)-7-(2-butoxyphenyl)-1-benzofuran-2-carboxamide
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| Structure |
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| Formula |
C26H30N2O3
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| Molecular Weight |
418.537
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| Canonical SMILES |
CCCCOc1ccccc1-c1cccc2cc(oc12)C(=O)NC1CN2CCC1CC2
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| InChI |
InChI=1S/C26H30N2O3/c1-2-3-15-30-23-10-5-4-8-20(23)21-9-6-7-19-16-24(31-25(19)21)26(29)27-22-17-28-13-11-18(22)12-14-28/h4-10,16,18,22H,2-3,11-15,17H2,1H3,(H,27,29)
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| InChIKey |
ZXWQDFNNOLBVAK-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