General Information of the Compound
| Compound ID |
CP0574800
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| Compound Name |
N-benzyl-5-[[2,5-diethoxy-4-(methanesulfonamido)phenyl]methylcarbamoylamino]-2-ethoxybenzamide
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| Structure |
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| Formula |
C29H36N4O7S
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| Molecular Weight |
584.695
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| Canonical SMILES |
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)NCc1ccccc1
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| InChI |
InChI=1S/C29H36N4O7S/c1-5-38-25-14-13-22(16-23(25)28(34)30-18-20-11-9-8-10-12-20)32-29(35)31-19-21-15-27(40-7-3)24(33-41(4,36)37)17-26(21)39-6-2/h8-17,33H,5-7,18-19H2,1-4H3,(H,30,34)(H2,31,32,35)
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| InChIKey |
SKMMZUAEYBWKAL-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