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Name | CHEMBL294735 |
---|---|
Molecular formula | C29H35N5O3 |
IUPAC name | 2-adamantyl N-[3-(benzotriazol-1-yl)-2-methyl-1-oxo-1-(2-phenylethylamino)propan-2-yl]carbamate |
Molecular weight | 501.631 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.7 |
Synonyms | BDBM50289882 (2-Benzotriazol-1-yl-1-methyl-1-phenethylcarbamoyl-ethyl)-carbamic acid adamantan-2-yl ester |
Inchi Key | FSNWQBMLDARLKU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H35N5O3/c1-29(18-34-25-10-6-5-9-24(25)32-33-34,27(35)30-12-11-19-7-3-2-4-8-19)31-28(36)37-26-22-14-20-13-21(16-22)17-23(26)15-20/h2-10,20-23,26H,11-18H2,1H3,(H,30,35)(H,31,36) |
PubChem CID | 44303488 |
ChEMBL | CHEMBL294735 |
IUPHAR | N/A |
BindingDB | 50289882 |
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 |
---|---|---|---|---|---|
86231 | Cholecystokinin receptor type A | P30551 | Cckar | Rattus norvegicus (Rat) | 444 |
86230 | Gastrin/cholecystokinin type B receptor | P56481 | Cckbr | Mus musculus (Mouse) | 453 |
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