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Name | CHEMBL18727 |
---|---|
Molecular formula | C27H30N4O2 |
IUPAC name | 7-methyl-N-[(2S)-1-oxo-1-(2-phenylethylamino)propan-2-yl]-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide |
Molecular weight | 442.563 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 3.7 |
Synonyms | BDBM50280052 7-Methyl-4,6,6a,7,8,9-hexahydro-indolo[4,3-fg]quinoline-9-carboxylic acid ((S)-1-phenethylcarbamoyl-ethyl)-amide |
Inchi Key | POTPSEYTYFJVAU-QWMSRCPPSA-N |
Inchi ID | InChI=1S/C27H30N4O2/c1-17(26(32)28-12-11-18-7-4-3-5-8-18)30-27(33)20-13-22-21-9-6-10-23-25(21)19(15-29-23)14-24(22)31(2)16-20/h3-10,13,15,17,20,24,29H,11-12,14,16H2,1-2H3,(H,28,32)(H,30,33)/t17-,20?,24?/m0/s1 |
PubChem CID | 44272230 |
ChEMBL | CHEMBL18727 |
IUPHAR | N/A |
BindingDB | 50280052 |
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 |
---|---|---|---|---|---|
265064 | Cholecystokinin receptor type A | O08786 | Cckar | Mus musculus (Mouse) | 436 |
265065 | Gastrin/cholecystokinin type B receptor | P56481 | Cckbr | Mus musculus (Mouse) | 453 |
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