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Name | CHEMBL389713 |
---|---|
Molecular formula | C31H36N6O5 |
IUPAC name | 2-[6-[[2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,3,4-benzotriazepin-3-yl]acetyl]amino]indazol-1-yl]acetic acid |
Molecular weight | 572.666 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.6 |
Synonyms | BDBM50002888 SCHEMBL3916758 |
Inchi Key | ABYTWJURXOUFNH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H36N6O5/c1-31(2,3)26(38)17-35-24-12-8-7-11-23(24)29(20-9-5-4-6-10-20)34-37(30(35)42)18-27(39)33-22-14-13-21-16-32-36(19-28(40)41)25(21)15-22/h7-8,11-16,20H,4-6,9-10,17-19H2,1-3H3,(H,33,39)(H,40,41) |
PubChem CID | 16732444 |
ChEMBL | CHEMBL389713 |
IUPHAR | N/A |
BindingDB | 50002888 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
1319 | Cholecystokinin receptor type A | P32238 | CCKAR | Homo sapiens (Human) | 428 |
1320 | Gastrin/cholecystokinin type B receptor | P32239 | CCKBR | Homo sapiens (Human) | 447 |
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