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Ligand

NameCHEMBL250912
Molecular formulaC27H31ClN2O2
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
Molecular weight451.007
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.6
SynonymsBDBM50423363
Inchi KeyHDLKZPVVWCGZOT-TZBSWOFLSA-N
Inchi IDInChI=1S/C27H31ClN2O2/c1-29-17-22(14-21-15-24-20(16-25(21)29)4-3-5-26(24)32-2)27(31)30-12-10-19(11-13-30)18-6-8-23(28)9-7-18/h3-10,21-22,25H,11-17H2,1-2H3/t21-,22-,25-/m1/s1
PubChem CID44441924
ChEMBLCHEMBL250912
IUPHARN/A
BindingDB50423363
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
112066Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
112067Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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