General Information of the Compound
| Compound ID |
CP0468847
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| Compound Name |
4-[5-(4-cyanophenyl)-6-(dimethylamino)pyridin-3-yl]-N-propan-2-ylbenzamide
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| Structure |
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| Formula |
C24H24N4O
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| Molecular Weight |
384.483
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| Canonical SMILES |
CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)
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| InChIKey |
QDVWKIWDKJSFEW-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