General Information of the Compound
| Compound ID |
CP0471794
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| Compound Name |
(2Z)-2-[[3-(3-phenylpropoxy)phenyl]methylidene]-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-3-one
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| Structure |
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| Formula |
C22H22N2O2S
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| Molecular Weight |
378.497
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| Canonical SMILES |
O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1
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| InChI |
InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-
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| InChIKey |
PLSWADCBNSNPGS-SILNSSARSA-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