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Ligand

NameASN 06396787
Molecular formulaC12H16Cl2N2O4S
IUPAC name[1-(2-methoxyethylamino)-3-methyl-1-oxobutan-2-yl] 4,5-dichloro-1,2-thiazole-3-carboxylate
Molecular weight355.23
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.3
SynonymsAC1MLIHC
SMR000278632
HMS2629J16
AKOS000738664
[1-(2-methoxyethylamino)-3-methyl-1-oxobutan-2-yl] 4,5-dichloro-1,2-thiazole-3-carboxylate
[ Show all ]
Inchi KeyCZBKVQPENRDSAJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H16Cl2N2O4S/c1-6(2)9(11(17)15-4-5-19-3)20-12(18)8-7(13)10(14)21-16-8/h6,9H,4-5H2,1-3H3,(H,15,17)
PubChem CID3220367
ChEMBLCHEMBL1580567
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
54133Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
54135Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
54134Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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