General Information of the Compound
| Compound ID |
CP0367838
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| Compound Name |
2-(4-bromophenyl)-N-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)phenyl]acetamide
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| Structure |
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| Formula |
C19H14BrN5O2
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| Molecular Weight |
424.258
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| Canonical SMILES |
Brc1ccc(CC(=O)Nc2ccc(Oc3ncnc4n[nH]cc34)cc2)cc1
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| InChI |
InChI=1S/C19H14BrN5O2/c20-13-3-1-12(2-4-13)9-17(26)24-14-5-7-15(8-6-14)27-19-16-10-23-25-18(16)21-11-22-19/h1-8,10-11H,9H2,(H,24,26)(H,21,22,23,25)
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| InChIKey |
RGMYTZVNRAGGPE-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