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Ligand

NameCHEMBL251753
Molecular formulaC31H34N6O4S2
IUPAC name[(3R,4aR,10aR)-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-6-yl] 4-methylbenzenesulfonate
Molecular weight618.771
Hydrogen bond acceptor10
Hydrogen bond donor0
XlogP4.7
SynonymsBDBM50423308
Inchi KeyKQVZHKXGWOSRCW-AZSVPQILSA-N
Inchi IDInChI=1S/C31H34N6O4S2/c1-20-6-8-24(9-7-20)43(39,40)41-28-5-3-4-21-18-27-22(17-25(21)28)16-23(19-35(27)2)31(38)37-14-12-36(13-15-37)29-11-10-26-30(32-29)34-42-33-26/h3-11,22-23,27H,12-19H2,1-2H3/t22-,23-,27-/m1/s1
PubChem CID44441672
ChEMBLCHEMBL251753
IUPHARN/A
BindingDB50423308
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
175936Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
175937Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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