General Information of the Compound
| Compound ID |
CP0524141
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| Compound Name |
2-(4-methoxyphenyl)-4-(pyrimidin-2-ylsulfanylmethyl)-1,3-thiazole
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| Structure |
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| Formula |
C15H13N3OS2
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| Molecular Weight |
315.423
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(CSc2ncccn2)cs1
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| InChI |
InChI=1S/C15H13N3OS2/c1-19-13-5-3-11(4-6-13)14-18-12(9-20-14)10-21-15-16-7-2-8-17-15/h2-9H,10H2,1H3
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| InChIKey |
HEQMOOXRPAHYCE-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