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Ligand

NameCHEMBL402296
Molecular formulaC26H30F2N2
IUPAC name2-benzyl-4-[4-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]phenyl]-3,3a,6,6a-tetrahydro-1H-cyclopenta[c]pyrrole
Molecular weight408.537
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.0
SynonymsBDBM50374094
SCHEMBL14538750
Inchi KeyARXINUPRMISVLG-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H30F2N2/c27-26(28)13-15-29(19-26)14-12-20-6-8-22(9-7-20)24-11-10-23-17-30(18-25(23)24)16-21-4-2-1-3-5-21/h1-9,11,23,25H,10,12-19H2
PubChem CID44454743
ChEMBLCHEMBL402296
IUPHARN/A
BindingDB50374094
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
12856Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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