General Information of the Compound
| Compound ID |
CP0430070
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| Compound Name |
2-(3,4-dichlorophenyl)-N-[[6-[4-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
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| Structure |
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| Formula |
C21H16Cl2F3N3S
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| Molecular Weight |
470.347
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-c1nc2sccn2c1CNCCc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C21H16Cl2F3N3S/c22-16-6-1-13(11-17(16)23)7-8-27-12-18-19(28-20-29(18)9-10-30-20)14-2-4-15(5-3-14)21(24,25)26/h1-6,9-11,27H,7-8,12H2
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| InChIKey |
YFQXADHNTBCBFF-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