General Information of the Compound
| Compound ID |
CP0188748
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| Compound Name |
tert-butyl N-[[4-amino-1-methyl-7-(1H-pyrazol-5-yl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylcarbamate
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| Structure |
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| Formula |
C22H27N7O2
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| Molecular Weight |
421.505
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| Canonical SMILES |
CCN(Cc1nc2c(N)nc3cc(ccc3c2n1C)-c1cc[nH]n1)C(=O)OC(C)(C)C
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| InChI |
InChI=1S/C22H27N7O2/c1-6-29(21(30)31-22(2,3)4)12-17-26-18-19(28(17)5)14-8-7-13(15-9-10-24-27-15)11-16(14)25-20(18)23/h7-11H,6,12H2,1-5H3,(H2,23,25)(H,24,27)
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| InChIKey |
DIWFOFHISQQHEB-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