General Information of the Compound
| Compound ID |
CP0571057
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| Compound Name |
4-[[2-(2,4-dimethoxyphenyl)-7-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
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| Structure |
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| Formula |
C27H37N5O3
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| Molecular Weight |
479.625
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| Canonical SMILES |
COc1ccc(-c2nc3cc(ccn3c2CN2CCOCC2)N2CCN(CC2)C(C)C)c(OC)c1
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| InChI |
InChI=1S/C27H37N5O3/c1-20(2)30-9-11-31(12-10-30)21-7-8-32-24(19-29-13-15-35-16-14-29)27(28-26(32)17-21)23-6-5-22(33-3)18-25(23)34-4/h5-8,17-18,20H,9-16,19H2,1-4H3
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| InChIKey |
IMPSBXPZQTZDBB-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: PT01922, Toll-like receptor 9