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Ligand

NameAC1OWPG0
Molecular formulaC18H15N3O6S
IUPAC name[2-[[3-ethoxycarbonyl-4-(furan-2-yl)thiophen-2-yl]amino]-2-oxoethyl] pyrazine-2-carboxylate
Molecular weight401.393
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.4
SynonymsAB00910732-05
MolPort-004-673-455
[2-[[3-ethoxycarbonyl-4-(furan-2-yl)thiophen-2-yl]amino]-2-oxoethyl] pyrazine-2-carboxylate
MCULE-7017101102
SMR000706300
[ Show all ]
Inchi KeyACCWXHUEZYHVFI-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H15N3O6S/c1-2-25-18(24)15-11(13-4-3-7-26-13)10-28-16(15)21-14(22)9-27-17(23)12-8-19-5-6-20-12/h3-8,10H,2,9H2,1H3,(H,21,22)
PubChem CID7985822
ChEMBLCHEMBL1591870
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1440Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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