General Information of the Compound
| Compound ID |
CP0489752
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| Compound Name |
N-[[2-(4-chlorophenyl)imidazo[1,2-a]pyrimidin-3-yl]methyl]-2-(3,4-dichlorophenyl)ethanamine
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| Structure |
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| Formula |
C21H17Cl3N4
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| Molecular Weight |
431.754
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| Canonical SMILES |
Clc1ccc(cc1)-c1nc2ncccn2c1CNCCc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C21H17Cl3N4/c22-16-5-3-15(4-6-16)20-19(28-11-1-9-26-21(28)27-20)13-25-10-8-14-2-7-17(23)18(24)12-14/h1-7,9,11-12,25H,8,10,13H2
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| InChIKey |
VKJSSHMFDQZWIU-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