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Ligand

NameCHEMBL249111
Molecular formulaC27H32N6O3S
IUPAC name1-[(3R,4aR,10aR)-6-methoxy-1-methyl-3-[4-([1,2,5]thiadiazolo[3,4-b]pyridin-5-yl)piperazine-1-carbonyl]-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-9-yl]ethanone
Molecular weight520.652
Hydrogen bond acceptor9
Hydrogen bond donor0
XlogP2.9
SynonymsBDBM50423313
Inchi KeyGBBWPPZDGCIUKR-PMAPCBKXSA-N
Inchi IDInChI=1S/C27H32N6O3S/c1-16(34)19-4-6-24(36-3)21-13-17-12-18(15-31(2)23(17)14-20(19)21)27(35)33-10-8-32(9-11-33)25-7-5-22-26(28-25)30-37-29-22/h4-7,17-18,23H,8-15H2,1-3H3/t17-,18-,23-/m1/s1
PubChem CID44441679
ChEMBLCHEMBL249111
IUPHARN/A
BindingDB50423313
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
92137Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
92138Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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