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Name | CHEMBL3800468 |
---|---|
Molecular formula | C29H32N2O5 |
IUPAC name | 8-hydroxy-5-[(1S)-1-hydroxy-2-[2-[3-methoxy-4-(3-phenylpropoxy)phenyl]ethylamino]ethyl]-1H-quinolin-2-one |
Molecular weight | 488.584 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 4 |
XlogP | 3.9 |
Synonyms | BDBM50167067 |
Inchi Key | PNROEQYQIZJINW-RUZDIDTESA-N |
Inchi ID | InChI=1S/C29H32N2O5/c1-35-27-18-21(9-13-26(27)36-17-5-8-20-6-3-2-4-7-20)15-16-30-19-25(33)22-10-12-24(32)29-23(22)11-14-28(34)31-29/h2-4,6-7,9-14,18,25,30,32-33H,5,8,15-17,19H2,1H3,(H,31,34)/t25-/m1/s1 |
PubChem CID | 127046948 |
ChEMBL | CHEMBL3800468 |
IUPHAR | N/A |
BindingDB | 50167067 |
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 |
---|---|---|---|---|---|
529105 | Beta-1 adrenergic receptor | P34971 | Adrb1 | Mus musculus (Mouse) | 466 |
529101 | Beta-2 adrenergic receptor | P07550 | ADRB2 | Homo sapiens (Human) | 413 |
529102 | D(1A) dopamine receptor | P21728 | DRD1 | Homo sapiens (Human) | 446 |
529104 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
529106 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
529103 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
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