General Information of the Compound
| Compound ID |
CP0495694
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3-(2-(4-chlorophenylsulfonamido)-4-(3-ethylureido)phenoxy)phenyl)acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22ClN3O6S
|
||||||||||||||||||
| Molecular Weight |
503.964
|
||||||||||||||||||
| Canonical SMILES |
CCNC(=O)Nc1ccc(Oc2cccc(CC(O)=O)c2)c(NS(=O)(=O)c2ccc(Cl)cc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22ClN3O6S/c1-2-25-23(30)26-17-8-11-21(33-18-5-3-4-15(12-18)13-22(28)29)20(14-17)27-34(31,32)19-9-6-16(24)7-10-19/h3-12,14,27H,2,13H2,1H3,(H,28,29)(H2,25,26,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BDWHHIMRPYMOMU-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound