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Ligand

NameCHEMBL3701950
Molecular formulaC20H20ClN3O
IUPAC nameN-[(2-chloroquinolin-3-yl)methyl]-4-[(2S)-morpholin-2-yl]aniline
Molecular weight353.85
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.7
SynonymsUS8802673, 51
BDBM129409
SCHEMBL12609839
Inchi KeyBQDOGNWVKQRWBL-LJQANCHMSA-N
Inchi IDInChI=1S/C20H20ClN3O/c21-20-16(11-15-3-1-2-4-18(15)24-20)12-23-17-7-5-14(6-8-17)19-13-22-9-10-25-19/h1-8,11,19,22-23H,9-10,12-13H2/t19-/m1/s1
PubChem CID86766836
ChEMBLCHEMBL3701950
IUPHARN/A
BindingDB129409
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
30177Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
30178Trace amine-associated receptor 7bQ923X8Taar7bRattus norvegicus (Rat)358

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