General Information of the Compound
| Compound ID |
CP0375733
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| Compound Name |
6-[(2-methoxyphenyl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C18H16N4OS2
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| Molecular Weight |
368.487
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| Canonical SMILES |
COc1ccccc1Cc1cc2c(N)nc(nc2s1)-c1nc(C)cs1
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| InChI |
InChI=1S/C18H16N4OS2/c1-10-9-24-18(20-10)16-21-15(19)13-8-12(25-17(13)22-16)7-11-5-3-4-6-14(11)23-2/h3-6,8-9H,7H2,1-2H3,(H2,19,21,22)
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| InChIKey |
PBOYDOVGTCZSGJ-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