General Information of the Compound
| Compound ID |
CP0524194
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-Chloro-5-(2,3-dihydro-benzofuran-5-yl)-1-(4-methanesulfonyl-phenyl)-1H-imidazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H15ClN2O3S
|
||||||||||||||||||
| Molecular Weight |
374.849
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)-n1cnc(Cl)c1-c1ccc2OCCc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H15ClN2O3S/c1-25(22,23)15-5-3-14(4-6-15)21-11-20-18(19)17(21)13-2-7-16-12(10-13)8-9-24-16/h2-7,10-11H,8-9H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MSZINACGMWACHB-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
Protein ID: PT00940, Prostaglandin G/H synthase 1
Protein ID: PT00901, Prostaglandin G/H synthase 2