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Ligand

NameCHEMBL250705
Molecular formulaC28H35N3O3
IUPAC name1-[4-[4-[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline-3-carbonyl]piperazin-1-yl]phenyl]ethanone
Molecular weight461.606
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.4
SynonymsBDBM50423349
Inchi KeyDSVNWTDGURPBDC-JQYIIUTOSA-N
Inchi IDInChI=1S/C28H35N3O3/c1-19(32)20-7-9-24(10-8-20)30-11-13-31(14-12-30)28(33)23-15-22-16-25-21(5-4-6-27(25)34-3)17-26(22)29(2)18-23/h4-10,22-23,26H,11-18H2,1-3H3/t22-,23-,26-/m1/s1
PubChem CID44441906
ChEMBLCHEMBL250705
IUPHARN/A
BindingDB50423349
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
68007Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
68008Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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