General Information of the Compound
| Compound ID |
CP0373588
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| Compound Name |
2-[1-(2-phenylphenoxy)ethyl]-4,5-dihydro-1,3-thiazole
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| Structure |
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| Formula |
C17H17NOS
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| Molecular Weight |
283.396
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| Canonical SMILES |
CC(Oc1ccccc1-c1ccccc1)C1=NCCS1
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| InChI |
InChI=1S/C17H17NOS/c1-13(17-18-11-12-20-17)19-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3
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| InChIKey |
LTDPDISPKAJTKJ-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: PT01650, Alpha-2A adrenergic receptor
Protein ID: PT02026, Alpha-2B adrenergic receptor
Protein ID: PT01598, Alpha-2C adrenergic receptor