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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 ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL3701920
Molecular formulaC17H22N4O
IUPAC nameN-[4-[(2S)-morpholin-2-yl]phenyl]-5-propylpyrimidin-2-amine
Molecular weight298.39
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.4
SynonymsSCHEMBL12609662
US8802673, 21
BDBM129379
Inchi KeyFAXHLOSHIRXFOH-MRXNPFEDSA-N
Inchi IDInChI=1S/C17H22N4O/c1-2-3-13-10-19-17(20-11-13)21-15-6-4-14(5-7-15)16-12-18-8-9-22-16/h4-7,10-11,16,18H,2-3,8-9,12H2,1H3,(H,19,20,21)/t16-/m1/s1
PubChem CID68325454
ChEMBLCHEMBL3701920
IUPHARN/A
BindingDB129379
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
73937Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
73936Trace amine-associated receptor 7bQ923X8Taar7bRattus norvegicus (Rat)358

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