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Ligand

NameCHEMBL1808416
Molecular formulaC33H41N5O4
IUPAC name1-[5-(1-adamantylmethyl)-1-(2-morpholin-4-ylethyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-3-phenylurea
Molecular weight571.722
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.9
SynonymsSCHEMBL7926069
BDBM50418880
L012441
Inchi KeyBGFWRBNIYHWASL-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H41N5O4/c39-30-29(35-32(41)34-26-6-2-1-3-7-26)31(40)38(22-33-19-23-16-24(20-33)18-25(17-23)21-33)28-9-5-4-8-27(28)37(30)11-10-36-12-14-42-15-13-36/h1-9,23-25,29H,10-22H2,(H2,34,35,41)
PubChem CID9872866
ChEMBLCHEMBL1808416
IUPHARN/A
BindingDB50418880
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
22954Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444

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