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Ligand

NameCHEMBL1555161
Molecular formulaC23H28ClFN4O4S
IUPAC name2-[(2-chloro-4-fluorophenyl)methylsulfonylmethyl]-N-[2-(diethylamino)ethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide
Molecular weight511.009
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP2.6
SynonymsAKOS021624744
HMS1919A15
2-{[(2-chloro-4-fluorobenzyl)sulfonyl]methyl}-N-[2-(diethylamino)ethyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
MolPort-007-930-506
K784-7100
[ Show all ]
Inchi KeyAHGMQAIFYUVQEJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28ClFN4O4S/c1-3-29(4-2)10-9-26-22(30)15-6-8-19-20(11-15)28-23(31)21(27-19)14-34(32,33)13-16-5-7-17(25)12-18(16)24/h5-8,11-12,21,27H,3-4,9-10,13-14H2,1-2H3,(H,26,30)(H,28,31)
PubChem CID16034814
ChEMBLCHEMBL1555161
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463550Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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