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Ligand

NameCHEMBL352131
Molecular formulaC22H20N4O2
IUPAC nameN-[(1R,2R)-2-aminocyclohexyl]-7-oxobenzo[e]perimidine-4-carboxamide
Molecular weight372.428
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.4
Synonyms7-Oxo-7H-benzo[e]perimidine-4-carboxylic acid ((1R,2R)-2-amino-cyclohexyl)-amide
BDBM50075920
N-[(1R)-2alpha-Aminocyclohexane-1beta-yl]-7-oxo-7H-benzo[e]perimidine-4-carboxamide
Inchi KeyYEIPENKZKGYLPU-IAGOWNOFSA-N
Inchi IDInChI=1S/C22H20N4O2/c23-16-7-3-4-8-17(16)26-22(28)15-10-9-14-18-19(24-11-25-20(15)18)12-5-1-2-6-13(12)21(14)27/h1-2,5-6,9-11,16-17H,3-4,7-8,23H2,(H,26,28)/t16-,17-/m1/s1
PubChem CID15381045
ChEMBLCHEMBL352131
IUPHARN/A
BindingDB50075920
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
408119Corticotropin-releasing factor receptor 1P35353Crhr1Rattus norvegicus (Rat)415
408120Corticotropin-releasing factor receptor 2Q60748Crhr2Mus musculus (Mouse)411

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