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Name | CHEMBL387018 |
---|---|
Molecular formula | C21H20BrN3O3S |
IUPAC name | N-[5-bromo-2-(piperidine-1-carbonyl)phenyl]isoquinoline-5-sulfonamide |
Molecular weight | 474.373 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | BDBM50196160 N-(5-bromo-2-(piperidine-1-carbonyl)phenyl)isoquinoline-5-sulfonamide 1-[4-bromo-2-[(isoquinolin-5-ylsulfonyl)amino]-benzoyl]-piperidine |
Inchi Key | FJGHNQFTCBCZGU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H20BrN3O3S/c22-16-7-8-18(21(26)25-11-2-1-3-12-25)19(13-16)24-29(27,28)20-6-4-5-15-14-23-10-9-17(15)20/h4-10,13-14,24H,1-3,11-12H2 |
PubChem CID | 16090686 |
ChEMBL | CHEMBL387018 |
IUPHAR | N/A |
BindingDB | 50196160 |
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 |
---|---|---|---|---|---|
79724 | Cholecystokinin receptor type A | P32238 | CCKAR | Homo sapiens (Human) | 428 |
79723 | Gastrin/cholecystokinin type B receptor | P32239 | CCKBR | Homo sapiens (Human) | 447 |
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