General Information of the Compound
| Compound ID |
CP0476824
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| Compound Name |
N-tert-butyl-1-(3-fluoropropyl)-8-methoxy-4-oxoquinoline-3-carboxamide
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| Structure |
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| Formula |
C18H23FN2O3
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| Molecular Weight |
334.391
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| Canonical SMILES |
COc1cccc2c1n(CCCF)cc(C(=O)NC(C)(C)C)c2=O
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| InChI |
InChI=1S/C18H23FN2O3/c1-18(2,3)20-17(23)13-11-21(10-6-9-19)15-12(16(13)22)7-5-8-14(15)24-4/h5,7-8,11H,6,9-10H2,1-4H3,(H,20,23)
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| InChIKey |
FTOCJIOLVFXZMR-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