General Information of the Compound
| Compound ID |
CP0469244
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-chloro-2-hydroxy-3-(2-methoxyethylsulfonyl)anilino]-4-phenyl-1,4-dihydroimidazol-5-one
Show/Hide
|
||||||||||||||||||
| Formula |
C18H18ClN3O5S
|
||||||||||||||||||
| Molecular Weight |
423.878
|
||||||||||||||||||
| Canonical SMILES |
COCCS(=O)(=O)c1c(Cl)ccc(NC2=NC(=O)C(N2)c2ccccc2)c1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18ClN3O5S/c1-27-9-10-28(25,26)16-12(19)7-8-13(15(16)23)20-18-21-14(17(24)22-18)11-5-3-2-4-6-11/h2-8,14,23H,9-10H2,1H3,(H2,20,21,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DYFXQMZMYIFFKC-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 | |||||||||||||||||||
| 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
Protein ID: PT01304, C-X-C chemokine receptor type 1
Protein ID: PT01013, C-X-C chemokine receptor type 2