General Information of the Compound
| Compound ID |
CP0856400
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| Compound Name |
6-(morpholinomethyl)-2-phenylthieno[2,3-d]-pyrimidin-4-amine
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| Structure |
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| Formula |
C17H18N4OS
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| Molecular Weight |
326.425
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| Canonical SMILES |
Nc1nc(-c2ccccc2)nc2sc(CN3CCOCC3)cc12
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| InChI |
InChI=1S/C17H18N4OS/c18-15-14-10-13(11-21-6-8-22-9-7-21)23-17(14)20-16(19-15)12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,18,19,20)
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| InChIKey |
YGJYAYOQTQTOSH-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: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a