General Information of the Compound
| Compound ID |
CP0543577
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| Compound Name |
7-(4-cyclopentylpiperazin-1-yl)-2-[4-methoxy-2-(3-pyrrolidin-1-ylpropoxy)phenyl]imidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C30H41N5O2
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| Molecular Weight |
503.691
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| Canonical SMILES |
COc1ccc(-c2cn3ccc(cc3n2)N2CCN(CC2)C2CCCC2)c(OCCCN2CCCC2)c1
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| InChI |
InChI=1S/C30H41N5O2/c1-36-26-9-10-27(29(22-26)37-20-6-14-32-12-4-5-13-32)28-23-35-15-11-25(21-30(35)31-28)34-18-16-33(17-19-34)24-7-2-3-8-24/h9-11,15,21-24H,2-8,12-14,16-20H2,1H3
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| InChIKey |
LKVJDKFXIKYIFN-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