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Ligand

NameCHEMBL251300
Molecular formulaC27H31N3O2
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)methanone
Molecular weight429.564
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50423336
Inchi KeyIJWFRTSKNOENFW-MPCDZSKCSA-N
Inchi IDInChI=1S/C27H31N3O2/c1-29-15-19(12-18-13-22-17(14-25(18)29)6-5-9-26(22)32-2)27(31)30-11-10-21-20-7-3-4-8-23(20)28-24(21)16-30/h3-9,18-19,25,28H,10-16H2,1-2H3/t18-,19-,25-/m1/s1
PubChem CID44441930
ChEMBLCHEMBL251300
IUPHARN/A
BindingDB50423336
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
135040Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
135039Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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