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Ligand

NameCHEMBL41189
Molecular formulaC28H44N2O7
IUPAC name(2S)-1-[2-[2-[2-[2-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]ethoxy]ethoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
Molecular weight520.667
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP2.9
SynonymsN/A
Inchi KeyBALOCXKMXYPXEC-ZEQRLZLVSA-N
Inchi IDInChI=1S/C28H44N2O7/c1-21(2)29-17-23(31)19-36-27-11-7-5-9-25(27)34-15-13-33-14-16-35-26-10-6-8-12-28(26)37-20-24(32)18-30-22(3)4/h5-12,21-24,29-32H,13-20H2,1-4H3/t23-,24-/m0/s1
PubChem CID13208878
ChEMBLCHEMBL41189
IUPHARN/A
BindingDBN/A
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
18968Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415
18969Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418

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