General Information of the Compound
| Compound ID |
CP0445861
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| Compound Name |
7-chloro-N-(2,6-difluorophenyl)-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
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| Structure |
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| Formula |
C11H5ClF2N4S
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| Molecular Weight |
298.705
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| Canonical SMILES |
Fc1cccc(F)c1Nc1nc2c(Cl)ncnc2s1
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| InChI |
InChI=1S/C11H5ClF2N4S/c12-9-8-10(16-4-15-9)19-11(18-8)17-7-5(13)2-1-3-6(7)14/h1-4H,(H,17,18)
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| InChIKey |
ZUGXGYFPBNSZEH-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