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Name | CHEMBL556416 |
---|---|
Molecular formula | C25H31N3O5S |
IUPAC name | 2-[3-[[(4-tert-butylphenyl)methyl-[(1-methylimidazol-2-yl)methylsulfonyl]amino]methyl]phenoxy]acetic acid |
Molecular weight | 485.599 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | BDBM50293494 2-(3-((N-(4-tert-butylbenzyl)-1-(1-methyl-1H-imidazol-2-yl)methylsulfonamido)methyl)phenoxy)acetic acid |
Inchi Key | TWMSTAGKFBLOEQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H31N3O5S/c1-25(2,3)21-10-8-19(9-11-21)15-28(34(31,32)18-23-26-12-13-27(23)4)16-20-6-5-7-22(14-20)33-17-24(29)30/h5-14H,15-18H2,1-4H3,(H,29,30) |
PubChem CID | 45266955 |
ChEMBL | CHEMBL556416 |
IUPHAR | N/A |
BindingDB | 50293494 |
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 |
---|---|---|---|---|---|
329178 | Prostaglandin E2 receptor EP2 subtype | Q62928 | Ptger2 | Rattus norvegicus (Rat) | 357 |
329179 | Prostaglandin E2 receptor EP4 subtype | P43114 | Ptger4 | Rattus norvegicus (Rat) | 488 |
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