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Ligand

NameCHEMBL248717
Molecular formulaC27H34N4O4S
IUPAC name[(3R,4aR,10aR)-6-methoxy-1-methyl-9-methylsulfanyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Molecular weight510.653
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.1
SynonymsBDBM50423304
Inchi KeyBIYHEELAFNLFEL-KHCICDEESA-N
Inchi IDInChI=1S/C27H34N4O4S/c1-28-17-19(14-18-15-22-23(16-24(18)28)26(36-3)9-8-25(22)35-2)27(32)30-12-10-29(11-13-30)20-4-6-21(7-5-20)31(33)34/h4-9,18-19,24H,10-17H2,1-3H3/t18-,19-,24-/m1/s1
PubChem CID44441676
ChEMBLCHEMBL248717
IUPHARN/A
BindingDB50423304
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
24863Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
24864Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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