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Name | CHEMBL3325625 |
---|---|
Molecular formula | C27H28N4O4 |
IUPAC name | 2-[3-[[4-(4-butanoyl-5-methylpyrazol-1-yl)phenyl]carbamoyl]-2,5-dimethylindol-1-yl]acetic acid |
Molecular weight | 472.545 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.2 |
Synonyms | BDBM50100270 |
Inchi Key | UUVDAWSNWMUOLR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H28N4O4/c1-5-6-24(32)22-14-28-31(17(22)3)20-10-8-19(9-11-20)29-27(35)26-18(4)30(15-25(33)34)23-12-7-16(2)13-21(23)26/h7-14H,5-6,15H2,1-4H3,(H,29,35)(H,33,34) |
PubChem CID | 118711064 |
ChEMBL | CHEMBL3325625 |
IUPHAR | N/A |
BindingDB | 50100270 |
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 |
---|---|---|---|---|---|
455469 | P2Y purinoceptor 12 | Q9H244 | P2RY12 | Homo sapiens (Human) | 342 |
455470 | P2Y purinoceptor 12 | Q9EPX4 | P2ry12 | Rattus norvegicus (Rat) | 343 |
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