General Information of the Compound
| Compound ID |
CP0469199
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| Compound Name |
4-Fluoro-N-[6-(2-furyl)-5-pyridin-4-ylpyrazin-2-yl]benzamide
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| Structure |
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| Formula |
C20H13FN4O2
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| Molecular Weight |
360.348
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
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| InChI |
InChI=1S/C20H13FN4O2/c21-15-5-3-14(4-6-15)20(26)25-17-12-23-18(13-7-9-22-10-8-13)19(24-17)16-2-1-11-27-16/h1-12H,(H,24,25,26)
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| InChIKey |
BKEYPKXKFJPYCZ-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: PT01278, Adenosine receptor A2b