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Ligand

NameSCHEMBL631592
Molecular formulaC12H13F2N3
IUPAC nameN-ethyl-3,4-difluoro-N-(1H-imidazol-5-ylmethyl)aniline
Molecular weight237.254
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.3
SynonymsCHEMBL3645389
(3,4-difluoro-phenyl)-ethyl-(3h-imidazol-4-ylmethyl)-amine
BDBM106594
1020815-00-2
US8586617, 58
Inchi KeyBKPYZFRTPMOBCU-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H13F2N3/c1-2-17(7-9-6-15-8-16-9)10-3-4-11(13)12(14)5-10/h3-6,8H,2,7H2,1H3,(H,15,16)
PubChem CID24947147
ChEMBLCHEMBL3645389
IUPHARN/A
BindingDB106594
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
26000Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332

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