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Ligand

NameCHEMBL230490
Molecular formulaC27H30Cl2N2O4
IUPAC nameN-[(3,4-dichlorophenyl)methyl]-2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]phenyl]acetamide
Molecular weight517.447
Hydrogen bond acceptor5
Hydrogen bond donor5
XlogP4.3
SynonymsSCHEMBL4260245
BDBM50326547
N-(3,4-dichlorobenzyl)-2-(3-((R)-2-((R)-2-hydroxy-2-(4-hydroxy-3-(hydroxymethyl)phenyl)ethylamino)propyl)phenyl)acetamide
Inchi KeyAOJZKEWJJYTGIX-QUGAMOGWSA-N
Inchi IDInChI=1S/C27H30Cl2N2O4/c1-17(30-15-26(34)21-6-8-25(33)22(13-21)16-32)9-18-3-2-4-19(10-18)12-27(35)31-14-20-5-7-23(28)24(29)11-20/h2-8,10-11,13,17,26,30,32-34H,9,12,14-16H2,1H3,(H,31,35)/t17-,26+/m1/s1
PubChem CID11214499
ChEMBLCHEMBL230490
IUPHARN/A
BindingDB50326547
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10299Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418
10300Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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