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Ligand

NameCHEMBL41474
Molecular formulaC27H42N2O6
IUPAC name(2S)-1-[2-[3-[2-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]propoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
Molecular weight490.641
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP3.4
SynonymsN/A
Inchi KeyGTLNYXYZJZBCGU-GOTSBHOMSA-N
Inchi IDInChI=1S/C27H42N2O6/c1-20(2)28-16-22(30)18-34-26-12-7-5-10-24(26)32-14-9-15-33-25-11-6-8-13-27(25)35-19-23(31)17-29-21(3)4/h5-8,10-13,20-23,28-31H,9,14-19H2,1-4H3/t22-,23-/m0/s1
PubChem CID13208856
ChEMBLCHEMBL41474
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
104960Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415
104961Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418

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