General Information of the Compound
| Compound ID |
CP0482509
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| Compound Name |
3-[3-[4-(1-aminocyclobutyl)phenyl]-5-(3-aminophenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;hydrochloride
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| Structure |
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| Formula |
C27H26ClN7
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| Molecular Weight |
484.007
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| Canonical SMILES |
Cl.Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
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| InChI |
InChI=1S/C27H25N7.ClH/c28-19-5-1-4-17(16-19)22-11-12-23-26(32-22)34(25(33-23)21-6-2-15-31-24(21)29)20-9-7-18(8-10-20)27(30)13-3-14-27;/h1-2,4-12,15-16H,3,13-14,28,30H2,(H2,29,31);1H
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| InChIKey |
XDKJSYWURYRAKR-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