General Information of the Compound
| Compound ID |
CP0443426
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| Compound Name |
N-methoxy-4-oxo-1-pentyl-7-phenylsulfanylquinoline-3-carboxamide
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| Structure |
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| Formula |
C22H24N2O3S
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| Molecular Weight |
396.512
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| Canonical SMILES |
CCCCCn1cc(C(=O)NOC)c(=O)c2ccc(Sc3ccccc3)cc12
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| InChI |
InChI=1S/C22H24N2O3S/c1-3-4-8-13-24-15-19(22(26)23-27-2)21(25)18-12-11-17(14-20(18)24)28-16-9-6-5-7-10-16/h5-7,9-12,14-15H,3-4,8,13H2,1-2H3,(H,23,26)
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| InChIKey |
XENACOZTWJREAQ-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2