General Information of the Compound
| Compound ID |
CP0537755
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| Compound Name |
6-bromo-3-methyl-2-phenyl-N-(1-pyridin-2-ylpropan-2-yl)quinoline-4-carboxamide
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| Formula |
C25H22BrN3O
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| Molecular Weight |
460.375
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| Canonical SMILES |
CC(Cc1ccccn1)NC(=O)c1c(C)c(nc2ccc(Br)cc12)-c1ccccc1
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| InChI |
InChI=1S/C25H22BrN3O/c1-16(14-20-10-6-7-13-27-20)28-25(30)23-17(2)24(18-8-4-3-5-9-18)29-22-12-11-19(26)15-21(22)23/h3-13,15-16H,14H2,1-2H3,(H,28,30)
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| InChIKey |
GEKYYXDRTUEUHI-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