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Ligand

NameObelin
Molecular formulaC26H32N4O4
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Molecular weight464.566
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.6
SynonymsNVP-SRA880
BDBM50423297
ZINC28949859
D00MGT
[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone
[ Show all ]
Inchi KeyINULNSAIIZKOQE-YOSAUDMPSA-N
Inchi IDInChI=1S/C26H32N4O4/c1-27-17-20(14-19-15-23-18(16-24(19)27)4-3-5-25(23)34-2)26(31)29-12-10-28(11-13-29)21-6-8-22(9-7-21)30(32)33/h3-9,19-20,24H,10-17H2,1-2H3/t19-,20-,24-/m1/s1
PubChem CID5311377
ChEMBLCHEMBL251541
IUPHAR2030
BindingDB50423297
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1376395-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
137638Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
137641D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467
137635Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
137636Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
137634Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
137640Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369
137633Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
137637Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
137642Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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