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Name | CHEMBL600083 |
---|---|
Molecular formula | C19H19BrClNO |
IUPAC name | (6aS,13bS)-4-bromo-11-chloro-7-methyl-5,6,6a,8,9,13b-hexahydronaphtho[1,2-a][3]benzazepin-12-ol |
Molecular weight | 392.721 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 5.1 |
Synonyms | BDBM50306454 SCHEMBL13900266 (6aS,13bS)-4-bromo-11-chloro-7-methyl-6,6a,7,8,9,13b-hexahydro-5H-benzo[d]naphtho[2,1-b]azepin-12-ol |
Inchi Key | BXQUKLOIAUHWPJ-PKOBYXMFSA-N |
Inchi ID | InChI=1S/C19H19BrClNO/c1-22-8-7-11-9-16(21)18(23)10-14(11)19-13-3-2-4-15(20)12(13)5-6-17(19)22/h2-4,9-10,17,19,23H,5-8H2,1H3/t17-,19+/m0/s1 |
PubChem CID | 46231845 |
ChEMBL | CHEMBL600083 |
IUPHAR | N/A |
BindingDB | 50306454 |
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 |
---|---|---|---|---|---|
35346 | D(1A) dopamine receptor | P21728 | DRD1 | Homo sapiens (Human) | 446 |
35343 | D(1B) dopamine receptor | P21918 | DRD5 | Homo sapiens (Human) | 477 |
35344 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
35345 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
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