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Ligand

NameCHEMBL251801
Molecular formulaC26H31N5O2S
IUPAC name[(6aR,9R,10aR)-7-methyl-5-methylsulfinyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
Molecular weight477.627
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.1
SynonymsBDBM50423461
Inchi KeyHVBWRNGARSBLLO-AREQPRTKSA-N
Inchi IDInChI=1S/C26H31N5O2S/c1-29-16-17(26(32)31-12-10-30(11-13-31)23-8-3-4-9-27-23)14-19-18-6-5-7-21-24(18)20(15-22(19)29)25(28-21)34(2)33/h3-9,17,19,22,28H,10-16H2,1-2H3/t17-,19-,22-,34?/m1/s1
PubChem CID44447023
ChEMBLCHEMBL251801
IUPHARN/A
BindingDB50423461
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
124833Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
124832Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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