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Name | CHEMBL549869 |
---|---|
Molecular formula | C21H27NO5S |
IUPAC name | 2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonylamino]methyl]phenoxy]acetic acid |
Molecular weight | 405.509 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.5 |
Synonyms | BDBM50293489 SCHEMBL5725362 2-(3-((N-(4-tert-butylbenzyl)methylsulfonamido)methyl)phenoxy)acetic acid |
Inchi Key | KLIXJEYHVBGSAB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H27NO5S/c1-21(2,3)18-10-8-16(9-11-18)13-22(28(4,25)26)14-17-6-5-7-19(12-17)27-15-20(23)24/h5-12H,13-15H2,1-4H3,(H,23,24) |
PubChem CID | 10126807 |
ChEMBL | CHEMBL549869 |
IUPHAR | N/A |
BindingDB | 50293489 |
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 |
---|---|---|---|---|---|
172015 | Prostaglandin E2 receptor EP2 subtype | Q62928 | Ptger2 | Rattus norvegicus (Rat) | 357 |
172014 | Prostaglandin E2 receptor EP4 subtype | P43114 | Ptger4 | Rattus norvegicus (Rat) | 488 |
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