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Ligand

NameCHEMBL253654
Molecular formulaC25H29N5O2
IUPAC name[(6aR,9R,10aR)-5-hydroxy-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
Molecular weight431.54
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsBDBM50423488
Inchi KeyFJTBWSARWMWNOD-HGHGUNKESA-N
Inchi IDInChI=1S/C25H29N5O2/c1-28-15-16(25(32)30-11-9-29(10-12-30)22-7-2-3-8-26-22)13-18-17-5-4-6-20-23(17)19(14-21(18)28)24(31)27-20/h2-8,16,18,21,27,31H,9-15H2,1H3/t16-,18-,21-/m1/s1
PubChem CID44447016
ChEMBLCHEMBL253654
IUPHARN/A
BindingDB50423488
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
80046Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
80045Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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