General Information of the Compound
| Compound ID |
CP0433742
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| Compound Name |
2-(furan-2-yl)-N-(furan-2-ylmethyl)-[1,2,4]triazolo[1,5-a]quinoxalin-4-amine
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| Structure |
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| Formula |
C18H13N5O2
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| Molecular Weight |
331.335
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| Canonical SMILES |
C(Nc1nc2ccccc2n2nc(nc12)-c1ccco1)c1ccco1
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| InChI |
InChI=1S/C18H13N5O2/c1-2-7-14-13(6-1)20-17(19-11-12-5-3-9-24-12)18-21-16(22-23(14)18)15-8-4-10-25-15/h1-10H,11H2,(H,19,20)
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| InChIKey |
OZJYVUMBRBPLLL-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