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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameSCHEMBL15111622
Molecular formulaC19H18FN3O
IUPAC name(2S)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
Molecular weight323.371
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
SynonymsBDBM190613
US9181230, 19
Inchi KeyANIXSCDCEWNQJP-LJQANCHMSA-N
Inchi IDInChI=1S/C19H18FN3O/c20-17-5-7-18(8-6-17)23-13-16(11-22-23)14-1-3-15(4-2-14)19-12-21-9-10-24-19/h1-8,11,13,19,21H,9-10,12H2/t19-/m1/s1
PubChem CID71656801
ChEMBLN/A
IUPHARN/A
BindingDB190613
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
557554Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
557555Trace amine-associated receptor 1Q923Y9Taar1Rattus norvegicus (Rat)332

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