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Ligand

NameCHEMBL492301
Molecular formulaC21H25ClN2O3S
IUPAC name7-[4-(2-chlorophenoxy)piperidin-1-yl]sulfonyl-2,3,4,5-tetrahydro-1H-3-benzazepine
Molecular weight420.952
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.8
Synonyms7-(4-(2-chlorophenoxy)piperidin-1-ylsulfonyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine
BDBM50257621
Inchi KeyZVFFUTQAERXNNF-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25ClN2O3S/c22-20-3-1-2-4-21(20)27-18-9-13-24(14-10-18)28(25,26)19-6-5-16-7-11-23-12-8-17(16)15-19/h1-6,15,18,23H,7-14H2
PubChem CID44225654
ChEMBLCHEMBL492301
IUPHARN/A
BindingDB50257621
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4383225-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
4383235-hydroxytryptamine receptor 2AO46635HTR2ACanis lupus familiaris (Dog)470
4383245-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
4383215-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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