General Information of the Compound
| Compound ID |
CP0847643
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| Compound Name |
3-(2-furyl)[1,2,4]triazino[4,3-a]benzimidazol-4-(10H)-one
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| Formula |
C13H8N4O2
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| Molecular Weight |
252.233
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| Canonical SMILES |
Oc1c(-c2ccco2)nnc2nc3ccccc3n12
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| InChI |
InChI=1S/C13H8N4O2/c18-12-11(10-6-3-7-19-10)15-16-13-14-8-4-1-2-5-9(8)17(12)13/h1-7,18H
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| InChIKey |
JMXFJDUFWZQJCE-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