General Information of the Compound
| Compound ID |
CP0388920
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| Compound Name |
CHEMBL3397519
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| Formula |
C22H26FNO2
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| Molecular Weight |
355.453
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| Canonical SMILES |
COc1c(C)cc(cc1C(=O)N[C@@H]1CC[C@H](C)CC1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C22H26FNO2/c1-14-4-10-19(11-5-14)24-22(25)20-13-17(12-15(2)21(20)26-3)16-6-8-18(23)9-7-16/h6-9,12-14,19H,4-5,10-11H2,1-3H3,(H,24,25)/t14-,19+
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| InChIKey |
ZVABXXHXRVMFOZ-DHFPXDALSA-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