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Ligand

NameCHEMBL250111
Molecular formulaC25H32N4O2
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
Molecular weight420.557
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.7
SynonymsBDBM50423367
Inchi KeyDKHKTKQQUHFLPD-TXTKFYIRSA-N
Inchi IDInChI=1S/C25H32N4O2/c1-27-17-20(14-19-15-22-18(16-23(19)27)4-3-5-24(22)31-2)25(30)29-12-10-28(11-13-29)21-6-8-26-9-7-21/h3-9,19-20,23H,10-17H2,1-2H3/t19-,20-,23-/m1/s1
PubChem CID44441867
ChEMBLCHEMBL250111
IUPHARN/A
BindingDB50423367
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
62259Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
62260Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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