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Ligand

NameCHEMBL337081
Molecular formulaC11H14N2O3S
IUPAC nameethyl 3-hydrazinyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylate
Molecular weight254.304
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.4
Synonyms3-Hydrazino-4-oxo-4,5,6,7-tetrahydro-benzo[c]thiophene-1-carboxylic acid ethyl ester
BDBM50048452
Inchi KeyAVPLPANPAQGMRQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H14N2O3S/c1-2-16-11(15)9-6-4-3-5-7(14)8(6)10(13-12)17-9/h13H,2-5,12H2,1H3
PubChem CID44353028
ChEMBLCHEMBL337081
IUPHARN/A
BindingDB50048452
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
15520Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
15519Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410

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