General Information of the Compound
| Compound ID |
CP0406461
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| Compound Name |
(E)-N-(4-chloroimidazo[1,5-a]quinoxalin-8-yl)-4-(dimethylamino)-N-methylbut-2-enamide
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| Structure |
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| Formula |
C17H18ClN5O
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| Molecular Weight |
343.818
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| Canonical SMILES |
CN(C)C\C=C\C(=O)N(C)c1ccc2nc(Cl)c3cncn3c2c1
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| InChI |
InChI=1S/C17H18ClN5O/c1-21(2)8-4-5-16(24)22(3)12-6-7-13-14(9-12)23-11-19-10-15(23)17(18)20-13/h4-7,9-11H,8H2,1-3H3/b5-4+
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| InChIKey |
AECWUIGFVNZNGR-SNAWJCMRSA-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: PT01308, Tyrosine-protein kinase BTK
Protein ID: PT00875, Tyrosine-protein kinase Lyn