General Information of the Compound
| Compound ID |
CP0415324
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| Compound Name |
6-Bromo-4-oxo-1-pentyl-1,4-dihydro-quinoline-3-carboxylic acid cyclohexylamide
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| Structure |
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| Formula |
C21H27BrN2O2
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| Molecular Weight |
419.363
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| Canonical SMILES |
CCCCCn1cc(C(=O)NC2CCCCC2)c(=O)c2cc(Br)ccc12
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| InChI |
InChI=1S/C21H27BrN2O2/c1-2-3-7-12-24-14-18(21(26)23-16-8-5-4-6-9-16)20(25)17-13-15(22)10-11-19(17)24/h10-11,13-14,16H,2-9,12H2,1H3,(H,23,26)
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| InChIKey |
ISUCVHDUSCKYMK-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