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Name | CHEMBL559955 |
---|---|
Molecular formula | C21H27NO4S |
IUPAC name | 3-[3-[(4-butylphenyl)methyl-methylsulfonylamino]phenyl]propanoic acid |
Molecular weight | 389.51 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | BDBM50293511 3-(3-(N-(4-butylbenzyl)methylsulfonamido)phenyl)propanoic acid |
Inchi Key | FDWQOVZKUZZVBT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H27NO4S/c1-3-4-6-17-9-11-19(12-10-17)16-22(27(2,25)26)20-8-5-7-18(15-20)13-14-21(23)24/h5,7-12,15H,3-4,6,13-14,16H2,1-2H3,(H,23,24) |
PubChem CID | 45268716 |
ChEMBL | CHEMBL559955 |
IUPHAR | N/A |
BindingDB | 50293511 |
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 |
---|---|---|---|---|---|
75977 | Prostaglandin E2 receptor EP2 subtype | Q62928 | Ptger2 | Rattus norvegicus (Rat) | 357 |
75978 | Prostaglandin E2 receptor EP4 subtype | P43114 | Ptger4 | Rattus norvegicus (Rat) | 488 |
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