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Name | CHEMBL3338270 |
---|---|
Molecular formula | C22H23N5O2 |
IUPAC name | 2-[1-[2-[(3,5-dimethyl-1,2,4-triazol-4-yl)methyl]-4-methylphenyl]-6-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid |
Molecular weight | 389.459 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.0 |
Synonyms | BDBM50035039 SCHEMBL14635736 |
Inchi Key | ANPDRIIKKDXHFX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H23N5O2/c1-13-5-8-20(18(9-13)12-26-15(3)24-25-16(26)4)27-11-17(10-21(28)29)19-7-6-14(2)23-22(19)27/h5-9,11H,10,12H2,1-4H3,(H,28,29) |
PubChem CID | 71225655 |
ChEMBL | CHEMBL3338270 |
IUPHAR | N/A |
BindingDB | 50035039 |
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 |
---|---|---|---|---|---|
442085 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
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