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Ligand

NameCHEMBL1808409
Molecular formulaC27H35N5O5
IUPAC name1-(4-hydroxyphenyl)-3-[1-(3-methylbutyl)-5-(2-morpholin-4-ylethyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]urea
Molecular weight509.607
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.4
SynonymsSCHEMBL8561454
BDBM50418902
Inchi KeyBORKBDSMEYAIER-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H35N5O5/c1-19(2)11-12-31-22-5-3-4-6-23(22)32(14-13-30-15-17-37-18-16-30)26(35)24(25(31)34)29-27(36)28-20-7-9-21(33)10-8-20/h3-10,19,24,33H,11-18H2,1-2H3,(H2,28,29,36)
PubChem CID19700621
ChEMBLCHEMBL1808409
IUPHARN/A
BindingDB50418902
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
29066Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444

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