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Ligand

NameYM-08316
Molecular formulaC23H30N2O9
IUPAC name(E)-but-2-enedioic acid;N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]phenyl]formamide;hydrate
Molecular weight478.498
Hydrogen bond acceptor10
Hydrogen bond donor7
XlogPNone
SynonymsFORMOTEROL FUMARATE
SCHEMBL4084169
BD-40A
CHEMBL1200811
CGP-25827A
Inchi KeyAXAGNMKWGBWLMO-SGGYECELSA-N
Inchi IDInChI=1S/C19H24N2O4.C4H4O4.H2O/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22;5-3(6)1-2-4(7)8;/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22);1-2H,(H,5,6)(H,7,8);1H2/b;2-1+;/t13-,19+;;/m1../s1
PubChem CID49800025
ChEMBLCHEMBL1200811
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16500Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
16497Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
16498Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418
16499Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408

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