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Ligand

NameCHEMBL1935601
Molecular formulaC21H20FNO4S
IUPAC name7-(3-fluorophenyl)sulfonylspiro[3,4-dihydro-2H-[1]benzofuro[2,3-c]pyridine-1,3'-oxane]
Molecular weight401.452
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.9
Synonyms7-[(3-fluorophenyl)sulfonyl]-3,4,5',6'-tetrahydro-2H,4'H-spiro[1-benzofuro[2,3-c]pyridine-1,3'-pyran]
BDBM50361053
OVDCCBDDPCBOAW-UHFFFAOYSA-N
SCHEMBL2225209
Inchi KeyOVDCCBDDPCBOAW-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20FNO4S/c22-14-3-1-4-15(11-14)28(24,25)16-5-6-17-18-7-9-23-21(8-2-10-26-13-21)20(18)27-19(17)12-16/h1,3-6,11-12,23H,2,7-10,13H2
PubChem CID53327611
ChEMBLCHEMBL1935601
IUPHARN/A
BindingDB50361053
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: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2510705-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
2510765-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
2510735-hydroxytryptamine receptor 6P31388Htr6Rattus norvegicus (Rat)436
2510745-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
251075Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
251072Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
251077D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
251071D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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