General Information of the Compound
| Compound ID |
CP0379450
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| Compound Name |
N-[2,6-bis(4-methylsulfanylphenyl)pyrimidin-4-yl]acetamide
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| Structure |
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| Formula |
C20H19N3OS2
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| Molecular Weight |
381.526
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| Canonical SMILES |
CSc1ccc(cc1)-c1cc(NC(C)=O)nc(n1)-c1ccc(SC)cc1
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| InChI |
InChI=1S/C20H19N3OS2/c1-13(24)21-19-12-18(14-4-8-16(25-2)9-5-14)22-20(23-19)15-6-10-17(26-3)11-7-15/h4-12H,1-3H3,(H,21,22,23,24)
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| InChIKey |
IHOJPHVYVFXUNM-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