General Information of the Compound
| Compound ID |
CP0534160
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| Compound Name |
5-[[2,5-diethoxy-4-(methanesulfonamido)phenyl]methylcarbamoylamino]-2-ethoxy-N-[(4-methoxyphenyl)methyl]benzamide
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| Structure |
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| Formula |
C30H38N4O8S
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| Molecular Weight |
614.721
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| Canonical SMILES |
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)NCc1ccc(OC)cc1
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| InChI |
InChI=1S/C30H38N4O8S/c1-6-40-26-14-11-22(16-24(26)29(35)31-18-20-9-12-23(39-4)13-10-20)33-30(36)32-19-21-15-28(42-8-3)25(34-43(5,37)38)17-27(21)41-7-2/h9-17,34H,6-8,18-19H2,1-5H3,(H,31,35)(H2,32,33,36)
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| InChIKey |
PUIDQLYMFYPKAE-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
Protein ID: PT02513, Steroid hormone receptor ERR1
Cell Viability or Cytotoxicity Assay