General Information of the Compound
| Compound ID |
CP0109175
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| Compound Name |
3-[(3-chlorophenyl)amino]-4-(2-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
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| Structure |
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| Formula |
C17H13ClN2O3
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| Molecular Weight |
328.755
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| Canonical SMILES |
COc1ccccc1C1=C(Nc2cccc(Cl)c2)C(=O)NC1=O
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| InChI |
InChI=1S/C17H13ClN2O3/c1-23-13-8-3-2-7-12(13)14-15(17(22)20-16(14)21)19-11-6-4-5-10(18)9-11/h2-9H,1H3,(H2,19,20,21,22)
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| InChIKey |
DQYDZCRLDYVZKY-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: PT01400, Dual specificity protein kinase CLK4
Protein ID: PT00931, Glycogen synthase kinase-3 alpha
Protein ID: PT01230, Serine/threonine-protein kinase 10
Protein ID: PT01185, Serine/threonine-protein kinase 25
Protein ID: PT02004, Serine/threonine-protein kinase 33
Protein ID: PT02071, Serine/threonine-protein kinase DCLK3
Protein ID: PT01332, Serine/threonine-protein kinase tousled-like 1
Protein ID: PT02087, Serine/threonine-protein kinase tousled-like 2
Protein ID: PT00960, STE20-like serine/threonine-protein kinase
Protein ID: PT00892, Tyrosine-protein kinase JAK3