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Ligand

NameCHEMBL3663716
Molecular formulaC21H19N5O
IUPAC name3-(3-cyanophenyl)-N-(4-pyrrolidin-3-ylphenyl)-1H-pyrazole-5-carboxamide
Molecular weight357.417
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.5
SynonymsSCHEMBL14152795
Inchi KeyANHNUPJURXDJCB-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H19N5O/c22-12-14-2-1-3-16(10-14)19-11-20(26-25-19)21(27)24-18-6-4-15(5-7-18)17-8-9-23-13-17/h1-7,10-11,17,23H,8-9,13H2,(H,24,27)(H,25,26)
PubChem CID71087892
ChEMBLCHEMBL3663716
IUPHARN/A
BindingDB167489
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
464036Trace amine-associated receptor 1Q923Y9Taar1Rattus norvegicus (Rat)332
464037Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332

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