General Information of the Compound
| Compound ID |
CP0461771
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| Compound Name |
methyl 4-amino-2-butyl-1-(2-hydroxyethyl)imidazo[4,5-c]quinoline-7-carboxylate
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| Structure |
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| Formula |
C18H22N4O3
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| Molecular Weight |
342.399
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| Canonical SMILES |
CCCCc1nc2c(N)nc3cc(ccc3c2n1CCO)C(=O)OC
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| InChI |
InChI=1S/C18H22N4O3/c1-3-4-5-14-21-15-16(22(14)8-9-23)12-7-6-11(18(24)25-2)10-13(12)20-17(15)19/h6-7,10,23H,3-5,8-9H2,1-2H3,(H2,19,20)
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| InChIKey |
STKCEXWJBRFRKU-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