General Information of the Compound
| Compound ID |
CP0874615
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| Compound Name |
N-[2-[(1,1-dioxothian-4-yl)-methyl-amino]-2-oxo-ethyl]-2-(4-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C17H24N2O5S
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| Molecular Weight |
368.455
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| Canonical SMILES |
COc1ccc(CC(=O)NCC(=O)N(C)C2CCS(=O)(=O)CC2)cc1
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| InChI |
InChI=1S/C17H24N2O5S/c1-19(14-7-9-25(22,23)10-8-14)17(21)12-18-16(20)11-13-3-5-15(24-2)6-4-13/h3-6,14H,7-12H2,1-2H3,(H,18,20)
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| InChIKey |
NJFBAFVTJKXINJ-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