General Information of the Compound
| Compound ID |
CP0438050
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| Compound Name |
(E)-1-[6-(4-tert-butylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]-N-[(3,4-dichlorophenyl)methoxy]methanimine
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| Structure |
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| Formula |
C23H21Cl2N3OS
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| Molecular Weight |
458.414
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)-c1nc2sccn2c1\C=N\OCc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C23H21Cl2N3OS/c1-23(2,3)17-7-5-16(6-8-17)21-20(28-10-11-30-22(28)27-21)13-26-29-14-15-4-9-18(24)19(25)12-15/h4-13H,14H2,1-3H3/b26-13+
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| InChIKey |
WEBQQUVOYAUIKQ-LGJNPRDNSA-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