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Name | SCHEMBL1569620 |
---|---|
Molecular formula | C28H25Cl2NO5 |
IUPAC name | 6-chloro-7-[4-[[3-(4-chlorophenyl)cyclopentyl]carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid |
Molecular weight | 526.41 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 6.2 |
Synonyms | BDBM233351 US9556139, 168 Sodium 6-chloro-7-(4-(3-(4-chlorophenyl)cyclopentylcarbamoyl)phenoxy)chroman-4-carboxylate |
Inchi Key | ANVJJSFTQHVXII-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H25Cl2NO5/c29-19-6-1-16(2-7-19)18-3-8-20(13-18)31-27(32)17-4-9-21(10-5-17)36-26-15-25-23(14-24(26)30)22(28(33)34)11-12-35-25/h1-2,4-7,9-10,14-15,18,20,22H,3,8,11-13H2,(H,31,32)(H,33,34) |
PubChem CID | 67080236 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 233351 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
557563 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
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