General Information of the Compound
| Compound ID |
CP0445156
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| Compound Name |
N-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-(3,4-dichlorophenyl)-N-methylethanamine
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| Structure |
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| Formula |
C21H18Cl3N3S
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| Molecular Weight |
450.822
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| Canonical SMILES |
CN(CCc1ccc(Cl)c(Cl)c1)Cc1c(nc2sccn12)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H18Cl3N3S/c1-26(9-8-14-2-7-17(23)18(24)12-14)13-19-20(15-3-5-16(22)6-4-15)25-21-27(19)10-11-28-21/h2-7,10-12H,8-9,13H2,1H3
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| InChIKey |
PMCXCSHAJBEXRB-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