General Information of the Compound
| Compound ID |
CP0423726
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| Compound Name |
2-(3,4-dichlorophenyl)-N-[[6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
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| Structure |
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| Formula |
C21H19Cl2N3OS
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| Molecular Weight |
432.376
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| Canonical SMILES |
COc1ccc(cc1)-c1nc2sccn2c1CNCCc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C21H19Cl2N3OS/c1-27-16-5-3-15(4-6-16)20-19(26-10-11-28-21(26)25-20)13-24-9-8-14-2-7-17(22)18(23)12-14/h2-7,10-12,24H,8-9,13H2,1H3
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| InChIKey |
AMDXEVFRALNSNL-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