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Ligand

NameCHEMBL95259
Molecular formulaC29H27N5O6
IUPAC name3-[[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-1,5-benzodiazepin-3-yl]carbamoylamino]benzoic acid
Molecular weight541.564
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.5
SynonymsSCHEMBL8946841
Inchi KeyDKGOEZIRYKWHII-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H27N5O6/c35-24(32-15-6-7-16-32)18-33-22-13-4-5-14-23(22)34(21-11-2-1-3-12-21)27(37)25(26(33)36)31-29(40)30-20-10-8-9-19(17-20)28(38)39/h1-5,8-14,17,25H,6-7,15-16,18H2,(H,38,39)(H2,30,31,40)
PubChem CID44328895
ChEMBLCHEMBL95259
IUPHARN/A
BindingDBN/A
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
62182Cholecystokinin receptor type AQ63931CCKARCavia porcellus (Guinea pig)430
62181Gastrin/cholecystokinin type B receptorP30553CckbrRattus norvegicus (Rat)452

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