General Information of the Compound
| Compound ID |
CP0529572
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| Compound Name |
1-[(4-fluorophenyl)methyl]-N-(4-methylcyclohexyl)-2-oxoquinoline-3-carboxamide
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| Structure |
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| Formula |
C24H25FN2O2
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| Molecular Weight |
392.474
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| Canonical SMILES |
CC1CCC(CC1)NC(=O)c1cc2ccccc2n(Cc2ccc(F)cc2)c1=O
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| InChI |
InChI=1S/C24H25FN2O2/c1-16-6-12-20(13-7-16)26-23(28)21-14-18-4-2-3-5-22(18)27(24(21)29)15-17-8-10-19(25)11-9-17/h2-5,8-11,14,16,20H,6-7,12-13,15H2,1H3,(H,26,28)
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| InChIKey |
NWYGVNMVIYNQSO-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