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Ligand

NameCHEMBL3972911
Molecular formulaC24H28N2O3
IUPAC name6,19-dimethoxy-18-propoxy-10,13-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-3(11),4(9),5,7,16,18,20-heptaene
Molecular weight392.499
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.3
SynonymsN/A
Inchi KeyASCOAXCJPGEUCZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H28N2O3/c1-4-9-29-24-10-15-7-8-26-14-21-19(12-22(26)17(15)13-23(24)28-3)18-11-16(27-2)5-6-20(18)25-21/h5-6,10-11,13,22,25H,4,7-9,12,14H2,1-3H3
PubChem CID134153556
ChEMBLCHEMBL3972911
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
548028Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466

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