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Ligand

NameMLS000098572
Molecular formulaC18H20N4O3S
IUPAC name2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Molecular weight372.443
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.2
Synonyms2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide
AKOS002497922
MLS002633432
2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(5-methyl-3-isoxazolyl)acetamide
CHEMBL1466287
[ Show all ]
Inchi KeyGXKVQFZVXGSINN-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20N4O3S/c1-3-4-9-22-17(24)13-7-5-6-8-14(13)19-18(22)26-11-16(23)20-15-10-12(2)25-21-15/h5-8,10H,3-4,9,11H2,1-2H3,(H,20,21,23)
PubChem CID2609971
ChEMBLCHEMBL1466287
IUPHARN/A
BindingDBN/A
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
107715Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
107712Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
107714Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
107713Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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