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Name | CHEMBL3673991 |
---|---|
Molecular formula | C22H20FN3O2S |
IUPAC name | 2-[7-[(5-fluoro-1,3-benzothiazol-2-yl)-methylamino]-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetic acid |
Molecular weight | 409.479 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | SCHEMBL13279333 US9096595, 6 BDBM173203 |
Inchi Key | APDRHYQYVDOJEH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H20FN3O2S/c1-25(22-24-17-10-13(23)6-9-20(17)29-22)14-7-8-19-16(11-21(27)28)15-4-2-3-5-18(15)26(19)12-14/h2-6,9-10,14H,7-8,11-12H2,1H3,(H,27,28) |
PubChem CID | 66571493 |
ChEMBL | CHEMBL3673991 |
IUPHAR | N/A |
BindingDB | 173203 |
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 |
---|---|---|---|---|---|
464217 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
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