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Ligand

NameCHEMBL163154
Molecular formulaC34H56N6O6
IUPAC name2-[6-[[2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]anilino]-2-oxoethyl]amino]hexylamino]-N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
Molecular weight644.858
Hydrogen bond acceptor10
Hydrogen bond donor8
XlogP2.0
SynonymsN/A
Inchi KeyJFRXWKSHJKGEAT-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H56N6O6/c1-25(2)37-19-29(41)23-45-31-13-9-27(10-14-31)39-33(43)21-35-17-7-5-6-8-18-36-22-34(44)40-28-11-15-32(16-12-28)46-24-30(42)20-38-26(3)4/h9-16,25-26,29-30,35-38,41-42H,5-8,17-24H2,1-4H3,(H,39,43)(H,40,44)
PubChem CID13755663
ChEMBLCHEMBL163154
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
149881Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
149882Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418

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