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Name | CHEMBL102526 |
---|---|
Molecular formula | C32H36N4O5 |
IUPAC name | benzyl (4R)-4-[(3-methylphenyl)carbamoylamino]-5-oxo-5-[4-(phenylcarbamoyl)piperidin-1-yl]pentanoate |
Molecular weight | 556.663 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 3.9 |
Synonyms | BDBM50286159 5-(R)-Oxo-5-(4-phenylcarbamoyl-piperidin-1-yl)-4-(3-m-tolyl-ureido)-pentanoic acid benzyl ester |
Inchi Key | CMUWMWYXXQZCFH-MUUNZHRXSA-N |
Inchi ID | InChI=1S/C32H36N4O5/c1-23-9-8-14-27(21-23)34-32(40)35-28(15-16-29(37)41-22-24-10-4-2-5-11-24)31(39)36-19-17-25(18-20-36)30(38)33-26-12-6-3-7-13-26/h2-14,21,25,28H,15-20,22H2,1H3,(H,33,38)(H2,34,35,40)/t28-/m1/s1 |
PubChem CID | 44334172 |
ChEMBL | CHEMBL102526 |
IUPHAR | N/A |
BindingDB | 50286159 |
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 |
---|---|---|---|---|---|
45724 | Cholecystokinin receptor type A | Q63931 | CCKAR | Cavia porcellus (Guinea pig) | 430 |
45723 | Gastrin/cholecystokinin type B receptor | P32239 | CCKBR | Homo sapiens (Human) | 447 |
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