General Information of the Compound
| Compound ID |
CP0490300
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| Compound Name |
N-[3-[3-[4-(aminomethyl)phenyl]-2-(2-aminopyridin-3-yl)imidazo[4,5-b]pyridin-5-yl]phenyl]acetamide;hydrochloride
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| Structure |
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| Formula |
C26H24ClN7O
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| Molecular Weight |
485.979
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| Canonical SMILES |
Cl.CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1
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| InChI |
InChI=1S/C26H23N7O.ClH/c1-16(34)30-19-5-2-4-18(14-19)22-11-12-23-26(31-22)33(20-9-7-17(15-27)8-10-20)25(32-23)21-6-3-13-29-24(21)28;/h2-14H,15,27H2,1H3,(H2,28,29)(H,30,34);1H
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| InChIKey |
LVMQNBNZPASSTN-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
Protein ID: PT01131, RAC-beta serine/threonine-protein kinase
Protein ID: PT01022, RAC-gamma serine/threonine-protein kinase