General Information of the Compound
| Compound ID |
CP0397464
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| Compound Name |
N-[[4-[2-(2-aminopyridin-3-yl)-6-cyclopentylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]benzamide
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| Structure |
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| Formula |
C30H28N6O
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| Molecular Weight |
488.595
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| Canonical SMILES |
Nc1ncccc1-c1nc2cc(cnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)C1CCCC1
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| InChI |
InChI=1S/C30H28N6O/c31-27-25(11-6-16-32-27)28-35-26-17-23(21-7-4-5-8-21)19-33-29(26)36(28)24-14-12-20(13-15-24)18-34-30(37)22-9-2-1-3-10-22/h1-3,6,9-17,19,21H,4-5,7-8,18H2,(H2,31,32)(H,34,37)
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| InChIKey |
NSAYDSOCAFUODA-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: PT00845, RAC-alpha serine/threonine-protein kinase
Cell-based Assay
Protein ID: PT01131, RAC-beta serine/threonine-protein kinase
Protein ID: PT01022, RAC-gamma serine/threonine-protein kinase