General Information of the Compound
| Compound ID |
CP0083292
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| Compound Name |
N-(4-chlorophenyl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide
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| Structure |
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| Formula |
C13H12ClN3O2S
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| Molecular Weight |
309.778
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| Canonical SMILES |
Cc1cc(SCC(=O)Nc2ccc(Cl)cc2)[nH]c(=O)n1
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| InChI |
InChI=1S/C13H12ClN3O2S/c1-8-6-12(17-13(19)15-8)20-7-11(18)16-10-4-2-9(14)3-5-10/h2-6H,7H2,1H3,(H,16,18)(H,15,17,19)
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| InChIKey |
FINUXUYAVBTGFP-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