General Information of the Compound
| Compound ID |
CP0396308
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| Compound Name |
(4Z)-4-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-2-[(4-methylphenyl)methylsulfanyl]-1H-imidazol-5-one
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| Structure |
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| Formula |
C25H21ClN2O2S
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| Molecular Weight |
448.975
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| Canonical SMILES |
Cc1ccc(CSC2=N\C(=C/c3cccc(OCc4ccc(Cl)cc4)c3)C(=O)N2)cc1
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| InChI |
InChI=1S/C25H21ClN2O2S/c1-17-5-7-19(8-6-17)16-31-25-27-23(24(29)28-25)14-20-3-2-4-22(13-20)30-15-18-9-11-21(26)12-10-18/h2-14H,15-16H2,1H3,(H,27,28,29)/b23-14-
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| InChIKey |
SNFXWOMCGKMJBQ-UCQKPKSFSA-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
Protein ID: PT05453, G-protein coupled receptor 55
Protein ID: PT06110, N-arachidonyl glycine receptor