General Information of the Compound
| Compound ID |
CP0019369
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| Compound Name |
8-bromo-2-piperidin-3-yl-3H-[1]benzofuro[3,2-d]pyrimidin-4-one
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| Structure |
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| Formula |
C15H14BrN3O2
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| Molecular Weight |
348.2
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| Canonical SMILES |
Brc1ccc2oc3c(nc([nH]c3=O)C3CCCNC3)c2c1
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| InChI |
InChI=1S/C15H14BrN3O2/c16-9-3-4-11-10(6-9)12-13(21-11)15(20)19-14(18-12)8-2-1-5-17-7-8/h3-4,6,8,17H,1-2,5,7H2,(H,18,19,20)
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| InChIKey |
XODCTWLLGVOGFI-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