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Ligand

NameCHEMBL248715
Molecular formulaC25H30N6O2S
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-([1,2,5]thiadiazolo[3,4-b]pyridin-5-yl)piperazin-1-yl]methanone
Molecular weight478.615
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.2
SynonymsBDBM50423302
Inchi KeyGYCOZFHSVQYDLZ-DBXWQHBBSA-N
Inchi IDInChI=1S/C25H30N6O2S/c1-29-15-18(12-17-13-19-16(14-21(17)29)4-3-5-22(19)33-2)25(32)31-10-8-30(9-11-31)23-7-6-20-24(26-23)28-34-27-20/h3-7,17-18,21H,8-15H2,1-2H3/t17-,18-,21-/m1/s1
PubChem CID44441669
ChEMBLCHEMBL248715
IUPHARN/A
BindingDB50423302
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
108135Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
108134Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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