General Information of the Compound
| Compound ID |
CP0526566
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| Compound Name |
2-phenyl-4-(pyrimidin-2-ylsulfanylmethyl)-1,3-thiazole
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| Structure |
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| Formula |
C14H11N3S2
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| Molecular Weight |
285.397
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| Canonical SMILES |
C(Sc1ncccn1)c1csc(n1)-c1ccccc1
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| InChI |
InChI=1S/C14H11N3S2/c1-2-5-11(6-3-1)13-17-12(9-18-13)10-19-14-15-7-4-8-16-14/h1-9H,10H2
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| InChIKey |
UOFJARDSEYJTHA-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