General Information of the Compound
| Compound ID |
CP0418068
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| Compound Name |
6-amino-2-propan-2-ylpyrazolo[3,4-d]pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C9H12N6O
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| Molecular Weight |
220.236
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| Canonical SMILES |
CC(C)n1cc2c(nc(N)nc2n1)C(N)=O
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| InChI |
InChI=1S/C9H12N6O/c1-4(2)15-3-5-6(7(10)16)12-9(11)13-8(5)14-15/h3-4H,1-2H3,(H2,10,16)(H2,11,13,14)
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| InChIKey |
RAVXYIJUKCPXFE-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