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Ligand

NameCHEMBL567075
Molecular formulaC31H38N4O4S
IUPAC nameN-[(4R)-4-(3,4-dimethoxyphenyl)-4-[7-(4-ethylpiperazin-1-yl)-3-oxo-1H-isoindol-2-yl]butyl]thiophene-2-carboxamide
Molecular weight562.729
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.4
SynonymsSCHEMBL2344044
BDBM50302259
(R)-N-(4-(3,4-dimethoxyphenyl)-4-(4-(4-ethylpiperazin-1-yl)-1-oxoisoindolin-2-yl)butyl)thiophene-2-carboxamide
Inchi KeyDVCVBMAAHFGXPO-RUZDIDTESA-N
Inchi IDInChI=1S/C31H38N4O4S/c1-4-33-15-17-34(18-16-33)26-9-5-8-23-24(26)21-35(31(23)37)25(22-12-13-27(38-2)28(20-22)39-3)10-6-14-32-30(36)29-11-7-19-40-29/h5,7-9,11-13,19-20,25H,4,6,10,14-18,21H2,1-3H3,(H,32,36)/t25-/m1/s1
PubChem CID25126424
ChEMBLCHEMBL567075
IUPHARN/A
BindingDB50302259
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
69796Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389
69797Urotensin-2 receptorP49684Uts2rRattus norvegicus (Rat)386

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