General Information of the Compound
| Compound ID |
CP0415794
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| Compound Name |
2-fluoro-N-[4-[5-[4-(4-fluoropiperidin-1-yl)butylamino]-1,3,4-oxadiazol-2-yl]phenyl]benzamide
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| Structure |
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| Formula |
C24H27F2N5O2
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| Molecular Weight |
455.509
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| Canonical SMILES |
FC1CCN(CCCCNc2nnc(o2)-c2ccc(NC(=O)c3ccccc3F)cc2)CC1
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| InChI |
InChI=1S/C24H27F2N5O2/c25-18-11-15-31(16-12-18)14-4-3-13-27-24-30-29-23(33-24)17-7-9-19(10-8-17)28-22(32)20-5-1-2-6-21(20)26/h1-2,5-10,18H,3-4,11-16H2,(H,27,30)(H,28,32)
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| InChIKey |
PEIFUGDCVSOBAT-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
Protein ID: PT01846, Neuronal acetylcholine receptor subunit alpha-7
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2