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Name | CHEMBL1080117 |
---|---|
Molecular formula | C27H28ClN5S |
IUPAC name | 5-[5-[3-[1-(4-chlorophenyl)-3-azabicyclo[3.1.0]hexan-3-yl]propylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2-methylquinoline |
Molecular weight | 490.066 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 5.5 |
Synonyms | BDBM50415697 |
Inchi Key | AAONJNLMLWRZJE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H28ClN5S/c1-18-7-12-22-23(5-3-6-24(22)29-18)25-30-31-26(32(25)2)34-14-4-13-33-16-20-15-27(20,17-33)19-8-10-21(28)11-9-19/h3,5-12,20H,4,13-17H2,1-2H3 |
PubChem CID | 44626740 |
ChEMBL | CHEMBL1080117 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
393 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
392 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
394 | Histamine H3 receptor | Q9Y5N1 | HRH3 | Homo sapiens (Human) | 445 |
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