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Name | CHEMBL550619 |
---|---|
Molecular formula | C22H29NO4S |
IUPAC name | 2-[4-[2-[(4-butylphenyl)methyl-methylsulfonylamino]ethyl]phenyl]acetic acid |
Molecular weight | 403.537 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.3 |
Synonyms | (4-{2-[(4-butyl-benzyl)-methanesulfonyl-amino]-ethyl}-phenyl)-acetic acid BDBM50293507 SCHEMBL5726660 2-(4-(2-(N-(4-butylbenzyl)methylsulfonamido)ethyl)phenyl)acetic acid VMVSNMAPWLXDTK-UHFFFAOYSA-N |
Inchi Key | VMVSNMAPWLXDTK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H29NO4S/c1-3-4-5-18-8-12-21(13-9-18)17-23(28(2,26)27)15-14-19-6-10-20(11-7-19)16-22(24)25/h6-13H,3-5,14-17H2,1-2H3,(H,24,25) |
PubChem CID | 22246765 |
ChEMBL | CHEMBL550619 |
IUPHAR | N/A |
BindingDB | 50293507 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
358967 | Prostaglandin E2 receptor EP2 subtype | Q62928 | Ptger2 | Rattus norvegicus (Rat) | 357 |
358966 | Prostaglandin E2 receptor EP4 subtype | P43114 | Ptger4 | Rattus norvegicus (Rat) | 488 |
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