General Information of the Compound
| Compound ID |
CP0419826
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| Compound Name |
5-(ethylamino)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylic acid
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| Structure |
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| Formula |
C12H11N5O3
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| Molecular Weight |
273.252
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| Canonical SMILES |
CCNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
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| InChI |
InChI=1S/C12H11N5O3/c1-2-13-12-14-6-7(11(18)19)10-15-9(16-17(10)12)8-4-3-5-20-8/h3-6H,2H2,1H3,(H,13,14)(H,18,19)
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| InChIKey |
ZKXDVIJDWCKBCG-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