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Ligand

NameCHEMBL2160067
Molecular formulaC28H25ClN6O
IUPAC nameN-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-2-[(2R)-2-methylmorpholin-4-yl]-1,6-naphthyridin-5-amine
Molecular weight496.999
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.6
SynonymsBDBM50394397
N-[3-(5-Phenyl-1H-imidazole-2-yl)-4-chlorophenyl]-2-[(2R)-2alpha-methylmorpholino]-1,6-naphthyridine-5-amine
SCHEMBL1624551
Inchi KeyBSQHKYLMKDAHEX-GOSISDBHSA-N
Inchi IDInChI=1S/C28H25ClN6O/c1-18-17-35(13-14-36-18)26-10-8-21-24(33-26)11-12-30-27(21)32-20-7-9-23(29)22(15-20)28-31-16-25(34-28)19-5-3-2-4-6-19/h2-12,15-16,18H,13-14,17H2,1H3,(H,30,32)(H,31,34)/t18-/m1/s1
PubChem CID49840814
ChEMBLCHEMBL2160067
IUPHARN/A
BindingDB50394397
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
31906Smoothened homologP56726SmoMus musculus (Mouse)793
31907Smoothened homologQ99835SMOHomo sapiens (Human)787

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