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Ligand

NameCHEMBL3354948
Molecular formulaC22H20F2N4O
IUPAC name(2R,4R)-9-(2,4-difluorophenyl)-N-(2-pyridin-3-ylpropan-2-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxamide
Molecular weight394.426
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.2
SynonymsBDBM50040995
Inchi KeyBKROMADERDAIKE-IUODEOHRSA-N
Inchi IDInChI=1S/C22H20F2N4O/c1-22(2,13-4-3-7-25-11-13)26-21(29)19-16-9-12-8-15(12)20(16)28(27-19)18-6-5-14(23)10-17(18)24/h3-7,10-12,15H,8-9H2,1-2H3,(H,26,29)/t12-,15-/m1/s1
PubChem CID118720561
ChEMBLCHEMBL3354948
IUPHARN/A
BindingDB50040995
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442693Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
442694Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
442691Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
442692Cannabinoid receptor 2Q9QZN9Cnr2Rattus norvegicus (Rat)360

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