General Information of the Compound
| Compound ID |
CP0547535
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| Compound Name |
N-(4-chloropyridin-3-yl)-4-[[3-(4-fluorophenoxy)phenyl]methyl]piperazine-1-carboxamide
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| Structure |
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| Formula |
C23H22ClFN4O2
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| Molecular Weight |
440.906
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| Canonical SMILES |
Fc1ccc(Oc2cccc(CN3CCN(CC3)C(=O)Nc3cnccc3Cl)c2)cc1
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| InChI |
InChI=1S/C23H22ClFN4O2/c24-21-8-9-26-15-22(21)27-23(30)29-12-10-28(11-13-29)16-17-2-1-3-20(14-17)31-19-6-4-18(25)5-7-19/h1-9,14-15H,10-13,16H2,(H,27,30)
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| InChIKey |
PJHNFCQBWRSKBM-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: PT01099, Fatty-acid amide hydrolase 1
Protein ID: PT00961, Fatty-acid amide hydrolase 1