General Information of the Compound
| Compound ID |
CP0541522
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| Compound Name |
5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
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| Structure |
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| Formula |
C19H16ClN3O3S
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| Molecular Weight |
401.875
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| Canonical SMILES |
COc1cc(cc(OC)c1OC)-c1nc2sc(cn2n1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H16ClN3O3S/c1-24-14-8-12(9-15(25-2)17(14)26-3)18-21-19-23(22-18)10-16(27-19)11-4-6-13(20)7-5-11/h4-10H,1-3H3
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| InChIKey |
OKSDPIMWCGVMGB-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