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Ligand

NameJNJ-39319202
Molecular formulaC30H38N4O5S2
IUPAC nameN-[(4R)-4-(3,4-dimethoxyphenyl)-4-[7-(4-ethylpiperazin-1-yl)-3-oxo-1H-isoindol-2-yl]butyl]thiophene-2-sulfonamide
Molecular weight598.777
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP4.1
SynonymsZINC43204087
(R)-N-(4-(3,4-dimethoxyphenyl)-4-(4-(4-ethylpiperazin-1-yl)-1-oxoisoindolin-2-yl)butyl)thiophene-2-sulfonamide
GTPL9437
N-[(4R)-4-(3,4-dimethoxyphenyl)-4-[7-(4-ethylpiperazin-1-yl)-3-oxo-1H-isoindol-2-yl]butyl]thiophene-2-sulfonamide
CHEMBL567713
[ Show all ]
Inchi KeyMWCLCGKVMLYVJI-RUZDIDTESA-N
Inchi IDInChI=1S/C30H38N4O5S2/c1-4-32-15-17-33(18-16-32)26-9-5-8-23-24(26)21-34(30(23)35)25(22-12-13-27(38-2)28(20-22)39-3)10-6-14-31-41(36,37)29-11-7-19-40-29/h5,7-9,11-13,19-20,25,31H,4,6,10,14-18,21H2,1-3H3/t25-/m1/s1
PubChem CID25126427
ChEMBLCHEMBL567713
IUPHAR9437
BindingDB50302257
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2157215-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
2157165-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
215720Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
215719Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
215717Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389
215718Urotensin-2 receptorP49684Uts2rRattus norvegicus (Rat)386

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