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Ligand

NameCHEMBL166168
Molecular formulaC28H28N4O5
IUPAC nameethyl 3-[[4-oxo-3-(3-propan-2-yloxyphenyl)quinazolin-2-yl]methylcarbamoylamino]benzoate
Molecular weight500.555
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.2
SynonymsBDBM50291402
3-{3-[3-(3-Isopropoxy-phenyl)-4-oxo-3,4-dihydro-quinazolin-2-ylmethyl]-ureido}-benzoic acid ethyl ester
Inchi KeyBTXKHCHLZQROCG-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H28N4O5/c1-4-36-27(34)19-9-7-10-20(15-19)30-28(35)29-17-25-31-24-14-6-5-13-23(24)26(33)32(25)21-11-8-12-22(16-21)37-18(2)3/h5-16,18H,4,17H2,1-3H3,(H2,29,30,35)
PubChem CID11755707
ChEMBLCHEMBL166168
IUPHARN/A
BindingDB50291402
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
32776Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
32775Gastrin/cholecystokinin type B receptorP56481CckbrMus musculus (Mouse)453

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