General Information of the Compound
| Compound ID |
CP0472949
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| Compound Name |
4-fluoro-N-[1-[2-(2-propan-2-ylphenoxy)ethyl]piperidin-4-yl]benzamide
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| Structure |
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| Formula |
C23H29FN2O2
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| Molecular Weight |
384.495
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| Canonical SMILES |
CC(C)c1ccccc1OCCN1CCC(CC1)NC(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C23H29FN2O2/c1-17(2)21-5-3-4-6-22(21)28-16-15-26-13-11-20(12-14-26)25-23(27)18-7-9-19(24)10-8-18/h3-10,17,20H,11-16H2,1-2H3,(H,25,27)
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| InChIKey |
HEYFBJDCLPTMGF-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7