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Ligand

NameCHEMBL348363
Molecular formulaC31H28N2O5
IUPAC name2-(diphenylcarbamoyl)-6-methoxy-5-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Molecular weight508.574
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50282398
5-Benzyloxy-2-diphenylcarbamoyl-6-methoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid
Inchi KeyAVTOGTIFKTWLLN-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H28N2O5/c1-37-28-18-17-23-20-32(31(36)33(24-13-7-3-8-14-24)25-15-9-4-10-16-25)27(30(34)35)19-26(23)29(28)38-21-22-11-5-2-6-12-22/h2-18,27H,19-21H2,1H3,(H,34,35)
PubChem CID44371045
ChEMBLCHEMBL348363
IUPHARN/A
BindingDB50282398
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
15629Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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