General Information of the Compound
| Compound ID |
CP0471265
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| Compound Name |
methyl 4-amino-2-butyl-1-(2-phenylmethoxyethyl)imidazo[4,5-c]quinoline-7-carboxylate
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| Structure |
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| Formula |
C25H28N4O3
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| Molecular Weight |
432.524
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| Canonical SMILES |
CCCCc1nc2c(N)nc3cc(ccc3c2n1CCOCc1ccccc1)C(=O)OC
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| InChI |
InChI=1S/C25H28N4O3/c1-3-4-10-21-28-22-23(29(21)13-14-32-16-17-8-6-5-7-9-17)19-12-11-18(25(30)31-2)15-20(19)27-24(22)26/h5-9,11-12,15H,3-4,10,13-14,16H2,1-2H3,(H2,26,27)
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| InChIKey |
FNZKARJUSMDEAM-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: PT02160, Toll-like receptor 7
Protein ID: PT02546, Toll-like receptor 8