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Ligand

NameCHEMBL25098
Molecular formulaC33H37N3O4
IUPAC name3-methyl-4-oxo-2-phenyl-N-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]chromene-8-carboxamide
Molecular weight539.676
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.6
SynonymsSCHEMBL8877390
BDBM50057456
3-Methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylic acid {3-[4-(2-isopropoxy-phenyl)-piperazin-1-yl]-propyl}-amide
Inchi KeyAJGRLCBBNXKRHK-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H37N3O4/c1-23(2)39-29-16-8-7-15-28(29)36-21-19-35(20-22-36)18-10-17-34-33(38)27-14-9-13-26-30(37)24(3)31(40-32(26)27)25-11-5-4-6-12-25/h4-9,11-16,23H,10,17-22H2,1-3H3,(H,34,38)
PubChem CID19972363
ChEMBLCHEMBL25098
IUPHARN/A
BindingDB50057456
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
6905Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
6906Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515

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