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Name | CHEMBL337692 |
---|---|
Molecular formula | C34H41N3O4 |
IUPAC name | 2-adamantyl 2-[(1-hydroxy-3-phenylpropan-2-yl)carbamoyl]-2-(1H-indol-3-ylmethyl)pyrrolidine-1-carboxylate |
Molecular weight | 555.719 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 5.6 |
Synonyms | 2-(1-Hydroxymethyl-2-phenyl-ethylcarbamoyl)-2-(1H-indol-3-ylmethyl)-pyrrolidine-1-carboxylic acid adamantan-2-yl ester BDBM50280444 |
Inchi Key | FFSBTDBRIVLLNZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C34H41N3O4/c38-21-28(18-22-7-2-1-3-8-22)36-32(39)34(19-27-20-35-30-10-5-4-9-29(27)30)11-6-12-37(34)33(40)41-31-25-14-23-13-24(16-25)17-26(31)15-23/h1-5,7-10,20,23-26,28,31,35,38H,6,11-19,21H2,(H,36,39) |
PubChem CID | 44353183 |
ChEMBL | CHEMBL337692 |
IUPHAR | N/A |
BindingDB | 50280444 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
77367 | Cholecystokinin receptor type A | P30551 | Cckar | Rattus norvegicus (Rat) | 444 |
77366 | Gastrin/cholecystokinin type B receptor | P56481 | Cckbr | Mus musculus (Mouse) | 453 |
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