General Information of the Compound
| Compound ID |
CP0153457
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| Compound Name |
N-[(4-amino-7-phenyl-3H-imidazo[4,5-c]quinolin-2-yl)methyl]-N-ethylacetamide
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| Structure |
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| Formula |
C21H21N5O
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| Molecular Weight |
359.433
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| Canonical SMILES |
CCN(Cc1nc2c(N)nc3cc(ccc3c2[nH]1)-c1ccccc1)C(C)=O
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| InChI |
InChI=1S/C21H21N5O/c1-3-26(13(2)27)12-18-24-19-16-10-9-15(14-7-5-4-6-8-14)11-17(16)23-21(22)20(19)25-18/h4-11H,3,12H2,1-2H3,(H2,22,23)(H,24,25)
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| InChIKey |
NIOGKLGRFWVTGS-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