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| Name | CHEMBL339115 |
|---|---|
| Molecular formula | C22H31ClN2O4 |
| IUPAC name | 4-[(3-chlorobenzoyl)amino]-5-[(4,4-diethylcyclohexyl)amino]-5-oxopentanoic acid |
| Molecular weight | 422.95 |
| Hydrogen bond acceptor | 4 |
| Hydrogen bond donor | 3 |
| XlogP | 4.6 |
| Synonyms | BDBM50008217 4-(3-Chloro-benzoylamino)-4-(4,4-diethyl-cyclohexylcarbamoyl)-butyric acid |
| Inchi Key | AFCWKTHKVQUQFI-UHFFFAOYSA-N |
| Inchi ID | InChI=1S/C22H31ClN2O4/c1-3-22(4-2)12-10-17(11-13-22)24-21(29)18(8-9-19(26)27)25-20(28)15-6-5-7-16(23)14-15/h5-7,14,17-18H,3-4,8-13H2,1-2H3,(H,24,29)(H,25,28)(H,26,27) |
| PubChem CID | 44349391 |
| ChEMBL | CHEMBL339115 |
| IUPHAR | N/A |
| BindingDB | 50008217 |
| 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 |
|---|---|---|---|---|---|
| 4044 | Cholecystokinin receptor type A | P30551 | Cckar | Rattus norvegicus (Rat) | 444 |
| 4045 | Gastrin/cholecystokinin type B receptor | P30553 | Cckbr | Rattus norvegicus (Rat) | 452 |
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