General Information of the Compound
| Compound ID |
CP0378327
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| Compound Name |
2-methyl-7,8-bis(oxidanyl)-3-(1-phenylpyrazol-4-yl)chromen-4-one
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| Structure |
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| Formula |
C19H14N2O4
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| Molecular Weight |
334.331
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| Canonical SMILES |
Cc1oc2c(O)c(O)ccc2c(=O)c1-c1cnn(c1)-c1ccccc1
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| InChI |
InChI=1S/C19H14N2O4/c1-11-16(12-9-20-21(10-12)13-5-3-2-4-6-13)17(23)14-7-8-15(22)18(24)19(14)25-11/h2-10,22,24H,1H3
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| InChIKey |
ZVWHFHQBQHDONN-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01214, Tyrosine-protein kinase JAK2