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Ligand

NameCHEMBL31416
Molecular formulaC20H25NO4
IUPAC namemethyl 3-[4-[3-(benzylamino)-2-hydroxypropoxy]phenyl]propanoate
Molecular weight343.423
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.4
SynonymsBDBM50404799
Inchi KeyALZSZHREWOBRCT-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H25NO4/c1-24-20(23)12-9-16-7-10-19(11-8-16)25-15-18(22)14-21-13-17-5-3-2-4-6-17/h2-8,10-11,18,21-22H,9,12-15H2,1H3
PubChem CID13040905
ChEMBLCHEMBL31416
IUPHARN/A
BindingDB50404799
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
8689Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418

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