General Information of the Compound
| Compound ID |
CP0946107
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| Compound Name |
N-[3-(3-Bromo-2-methyl-imidazo[1,2-a]pyridin-8-yloxymethyl)-2,4-dichloro-phenyl]-N-methyl-2-(3-m-tolyl-ureido)-acetamide hydrochloride
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| Structure |
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| Formula |
C26H25BrCl3N5O3
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| Molecular Weight |
641.781
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| Canonical SMILES |
Cc1cccc(NC(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)c1.Cl
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| InChI |
InChI=1S/C26H24BrCl2N5O3.ClH/c1-15-6-4-7-17(12-15)32-26(36)30-13-22(35)33(3)20-10-9-19(28)18(23(20)29)14-37-21-8-5-11-34-24(27)16(2)31-25(21)34;/h4-12H,13-14H2,1-3H3,(H2,30,32,36);1H
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| InChIKey |
WUJPIJUAEHCCJH-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