General Information of the Compound
| Compound ID |
CP0059564
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| Compound Name |
N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]acetamide
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| Structure |
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| Formula |
C13H11N5O2
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| Molecular Weight |
269.264
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| Canonical SMILES |
CC(=O)Nc1cc(nc(n1)-c1ccco1)-n1cccn1
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| InChI |
InChI=1S/C13H11N5O2/c1-9(19)15-11-8-12(18-6-3-5-14-18)17-13(16-11)10-4-2-7-20-10/h2-8H,1H3,(H,15,16,17,19)
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| InChIKey |
YBZHQFAVAQZLFB-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