General Information of the Compound
| Compound ID |
CP0415632
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| Compound Name |
US8895592, 26
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| Formula |
C23H24F3N3O3S
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| Molecular Weight |
479.524
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| Canonical SMILES |
CC(C)(O)COc1ccc(cc1C(=O)\N=c1/sc2ccncc2n1CC1CCC1)C(F)(F)F
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| InChI |
InChI=1S/C23H24F3N3O3S/c1-22(2,31)13-32-18-7-6-15(23(24,25)26)10-16(18)20(30)28-21-29(12-14-4-3-5-14)17-11-27-9-8-19(17)33-21/h6-11,14,31H,3-5,12-13H2,1-2H3/b28-21-
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| InChIKey |
MGNUPZHUTPRPFP-HFTWOUSFSA-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: PT00834, Cannabinoid receptor 2
Protein ID: PT02333, Cannabinoid receptor 2