General Information of the Compound
| Compound ID |
CP0539621
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| Compound Name |
8-(2,4-dichlorophenyl)-N,N-bis(2-methoxyethyl)-2,7-dimethylquinolin-4-amine
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| Structure |
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| Formula |
C23H26Cl2N2O2
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| Molecular Weight |
433.379
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| Canonical SMILES |
COCCN(CCOC)c1cc(C)nc2c(c(C)ccc12)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C23H26Cl2N2O2/c1-15-5-7-19-21(27(9-11-28-3)10-12-29-4)13-16(2)26-23(19)22(15)18-8-6-17(24)14-20(18)25/h5-8,13-14H,9-12H2,1-4H3
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| InChIKey |
KBLXXSRPZBDWLT-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