General Information of the Compound
| Compound ID |
CP0430009
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| Compound Name |
4-[6-amino-5-(4-cyanophenyl)pyridin-3-yl]-N-propan-2-ylbenzamide
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| Structure |
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| Formula |
C22H20N4O
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| Molecular Weight |
356.429
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| Canonical SMILES |
CC(C)NC(=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C22H20N4O/c1-14(2)26-22(27)18-9-7-16(8-10-18)19-11-20(21(24)25-13-19)17-5-3-15(12-23)4-6-17/h3-11,13-14H,1-2H3,(H2,24,25)(H,26,27)
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| InChIKey |
YUVLZPSSXDFUHH-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: PT01149, Misshapen-like kinase 1
Protein ID: PT01532, Mitogen-activated protein kinase kinase kinase kinase 4
Protein ID: PT02000, TRAF2 and NCK-interacting protein kinase