General Information of the Compound
| Compound ID |
CP0378326
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| Compound Name |
(E)-3-(5-Chloro-1-methyl-1H-imidazol-2-yl)-1-(2-hydroxy-phenyl)-propenone
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| Structure |
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| Formula |
C13H11ClN2O2
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| Molecular Weight |
262.696
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| Canonical SMILES |
Cn1c(Cl)cnc1\C=C\C(=O)c1ccccc1O
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| InChI |
InChI=1S/C13H11ClN2O2/c1-16-12(14)8-15-13(16)7-6-11(18)9-4-2-3-5-10(9)17/h2-8,17H,1H3/b7-6+
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| InChIKey |
QBBFQBPTZNVWQY-VOTSOKGWSA-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01214, Tyrosine-protein kinase JAK2