General Information of the Compound
| Compound ID |
CP0143768
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| Compound Name |
(5-chloro-2,3-dimethylquinolin-4-yl)-[4-(3,4-dimethylpiperazin-1-yl)phenyl]amine
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| Structure |
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| Formula |
C23H27ClN4
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| Molecular Weight |
394.95
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| Canonical SMILES |
CC1CN(CCN1C)c1ccc(Nc2c(C)c(C)nc3cccc(Cl)c23)cc1
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| InChI |
InChI=1S/C23H27ClN4/c1-15-14-28(13-12-27(15)4)19-10-8-18(9-11-19)26-23-16(2)17(3)25-21-7-5-6-20(24)22(21)23/h5-11,15H,12-14H2,1-4H3,(H,25,26)
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| InChIKey |
DZQRMYQZZBIVHO-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: PT01650, Alpha-2A adrenergic receptor
Protein ID: PT02026, Alpha-2B adrenergic receptor
Protein ID: PT01598, Alpha-2C adrenergic receptor