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Ligand

NameCHEMBL249112
Molecular formulaC26H32N4O4
IUPAC name[(3S,4aS,10aS)-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
SynonymsBDBM50423306
Inchi KeyINULNSAIIZKOQE-SKPFHBQLSA-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-/m0/s1
PubChem CID44441680
ChEMBLCHEMBL249112
IUPHARN/A
BindingDB50423306
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
137631Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
137632Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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