General Information of the Compound
| Compound ID |
CP0180553
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| Compound Name |
6-bromo-N-(3,4,5-trimethoxyphenyl)quinolin-4-amine
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| Structure |
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| Formula |
C18H17BrN2O3
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| Molecular Weight |
389.249
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| Canonical SMILES |
COc1cc(Nc2ccnc3ccc(Br)cc23)cc(OC)c1OC
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| InChI |
InChI=1S/C18H17BrN2O3/c1-22-16-9-12(10-17(23-2)18(16)24-3)21-15-6-7-20-14-5-4-11(19)8-13(14)15/h4-10H,1-3H3,(H,20,21)
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| InChIKey |
AUOSKLDNVNGKRR-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