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Ligand

NameCHEMBL249932
Molecular formulaC27H32N4O2
IUPAC name4-[4-[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline-3-carbonyl]piperazin-1-yl]benzonitrile
Molecular weight444.579
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.5
SynonymsBDBM50423348
Inchi KeyGVDMRBUYVYGHQH-TZBSWOFLSA-N
Inchi IDInChI=1S/C27H32N4O2/c1-29-18-22(14-21-15-24-20(16-25(21)29)4-3-5-26(24)33-2)27(32)31-12-10-30(11-13-31)23-8-6-19(17-28)7-9-23/h3-9,21-22,25H,10-16,18H2,1-2H3/t21-,22-,25-/m1/s1
PubChem CID44441898
ChEMBLCHEMBL249932
IUPHARN/A
BindingDB50423348
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
106158Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
106159Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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