General Information of the Compound
| Compound ID |
CP0420734
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| Compound Name |
N-(2,6-difluorophenyl)-7-pyrrolidin-1-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
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| Structure |
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| Formula |
C15H13F2N5S
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| Molecular Weight |
333.367
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| Canonical SMILES |
Fc1cccc(F)c1Nc1nc2c(ncnc2s1)N1CCCC1
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| InChI |
InChI=1S/C15H13F2N5S/c16-9-4-3-5-10(17)11(9)20-15-21-12-13(22-6-1-2-7-22)18-8-19-14(12)23-15/h3-5,8H,1-2,6-7H2,(H,20,21)
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| InChIKey |
DCQGCLTWVCOPKL-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
Protein ID: PT01278, Adenosine receptor A2b
Protein ID: PT01279, Adenosine receptor A3