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Ligand

NameCHEMBL2336758
Molecular formulaC29H37N5O6S
IUPAC nametert-butyl 3-[6,7-dimethoxy-4-(4-methylsulfonylanilino)quinazolin-2-yl]-3,9-diazabicyclo[4.2.1]nonane-9-carboxylate
Molecular weight583.704
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50429383
Inchi KeyAVZUGDCGZCTJAU-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H37N5O6S/c1-29(2,3)40-28(35)34-19-9-10-20(34)17-33(14-13-19)27-31-23-16-25(39-5)24(38-4)15-22(23)26(32-27)30-18-7-11-21(12-8-18)41(6,36)37/h7-8,11-12,15-16,19-20H,9-10,13-14,17H2,1-6H3,(H,30,31,32)
PubChem CID71717681
ChEMBLCHEMBL2336758
IUPHARN/A
BindingDB50429383
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
15804Glucose-dependent insulinotropic receptorQ8TDV5GPR119Homo sapiens (Human)335

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