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Name | SCHEMBL213839 |
---|---|
Molecular formula | C26H31NO6S |
IUPAC name | 4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-(2-methylpropyl)amino]phenoxy]methyl]-3-methylbenzoic acid |
Molecular weight | 485.595 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.8 |
Synonyms | IQXOMZMFCPBOBN-UHFFFAOYSA-N 3-methyl-4-[2-[N-isobutyl-N-(5-methyl-2-furylsulfonyl)amino]-4,5-dimethylphenoxymethyl]benzoic Acid CHEMBL3965638 US9181187, Compound C BDBM190565 |
Inchi Key | IQXOMZMFCPBOBN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H31NO6S/c1-16(2)14-27(34(30,31)25-10-7-20(6)33-25)23-12-17(3)18(4)13-24(23)32-15-22-9-8-21(26(28)29)11-19(22)5/h7-13,16H,14-15H2,1-6H3,(H,28,29) |
PubChem CID | 10299802 |
ChEMBL | CHEMBL3965638 |
IUPHAR | N/A |
BindingDB | 190565 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
518052 | Prostaglandin E2 receptor EP1 subtype | P35375 | Ptger1 | Mus musculus (Mouse) | 405 |
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