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Ligand

NameCHEMBL3929285
Molecular formulaC20H19F2N5O2
IUPAC name1-[4-(difluoromethoxy)phenyl]-N-(4-pyrrolidin-3-ylphenyl)triazole-4-carboxamide
Molecular weight399.402
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.2
SynonymsBDBM240696
SCHEMBL15578531
US9416127, 33
Inchi KeyASSNHRVAIIIIMI-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19F2N5O2/c21-20(22)29-17-7-5-16(6-8-17)27-12-18(25-26-27)19(28)24-15-3-1-13(2-4-15)14-9-10-23-11-14/h1-8,12,14,20,23H,9-11H2,(H,24,28)
PubChem CID73426214
ChEMBLCHEMBL3929285
IUPHARN/A
BindingDB240696
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
536346Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
536347Trace amine-associated receptor 1Q923Y9Taar1Rattus norvegicus (Rat)332

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