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Ligand

NameCHEMBL1808413
Molecular formulaC27H37N5O3
IUPAC name1-[5-[2-(diethylamino)ethyl]-1-(3-methylbutyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-3-phenylurea
Molecular weight479.625
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50418899
Inchi KeyBRLWQAZBALAKRT-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H37N5O3/c1-5-30(6-2)18-19-32-23-15-11-10-14-22(23)31(17-16-20(3)4)25(33)24(26(32)34)29-27(35)28-21-12-8-7-9-13-21/h7-15,20,24H,5-6,16-19H2,1-4H3,(H2,28,29,35)
PubChem CID56673523
ChEMBLCHEMBL1808413
IUPHARN/A
BindingDB50418899
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
31113Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444

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