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Ligand

NameCHEMBL250522
Molecular formulaC31H34N4O2
IUPAC name8-[4-[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline-3-carbonyl]piperazin-1-yl]naphthalene-2-carbonitrile
Molecular weight494.639
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.7
SynonymsBDBM50423344
Inchi KeyIANUKZYEFHFNGQ-ITLAICGJSA-N
Inchi IDInChI=1S/C31H34N4O2/c1-33-20-25(16-24-17-27-23(18-29(24)33)6-4-8-30(27)37-2)31(36)35-13-11-34(12-14-35)28-7-3-5-22-10-9-21(19-32)15-26(22)28/h3-10,15,24-25,29H,11-14,16-18,20H2,1-2H3/t24-,25-,29-/m1/s1
PubChem CID44441877
ChEMBLCHEMBL250522
IUPHARN/A
BindingDB50423344
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
128571Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
128572Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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