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Ligand

NameCHEMBL440236
Molecular formulaC26H32N4O6S
IUPAC name[(3R,4aR,10aR)-1-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-6-yl] methanesulfonate
Molecular weight528.624
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.1
SynonymsBDBM50423317
Inchi KeyIUODROSXFMPOIL-YOSAUDMPSA-N
Inchi IDInChI=1S/C26H32N4O6S/c1-27-17-20(14-19-15-23-18(16-24(19)27)4-3-5-25(23)36-37(2,34)35)26(31)29-12-10-28(11-13-29)21-6-8-22(9-7-21)30(32)33/h3-9,19-20,24H,10-17H2,1-2H3/t19-,20-,24-/m1/s1
PubChem CID44441665
ChEMBLCHEMBL440236
IUPHARN/A
BindingDB50423317
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
142207Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
142206Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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