General Information of the Compound
| Compound ID |
CP0381547
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| Compound Name |
6-benzyl-2-phenylthieno[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C19H15N3S
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| Molecular Weight |
317.417
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| Canonical SMILES |
Nc1nc(nc2sc(Cc3ccccc3)cc12)-c1ccccc1
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| InChI |
InChI=1S/C19H15N3S/c20-17-16-12-15(11-13-7-3-1-4-8-13)23-19(16)22-18(21-17)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,20,21,22)
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| InChIKey |
YCJUYKBUDGJHNY-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