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Ligand

NameCHEMBL248716
Molecular formulaC26H31BrN4O4
IUPAC name[(3R,4aR,10aR)-9-bromo-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Molecular weight543.462
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.3
SynonymsBDBM50423296
Inchi KeyBGGCZYSOBFCLJX-QZTZHPFYSA-N
Inchi IDInChI=1S/C26H31BrN4O4/c1-28-16-18(13-17-14-22-21(15-24(17)28)23(27)7-8-25(22)35-2)26(32)30-11-9-29(10-12-30)19-3-5-20(6-4-19)31(33)34/h3-8,17-18,24H,9-16H2,1-2H3/t17-,18-,24-/m1/s1
PubChem CID44441675
ChEMBLCHEMBL248716
IUPHARN/A
BindingDB50423296
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
22965Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
22966Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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