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Ligand

NameCHEMBL565388
Molecular formulaC38H44N6O5
IUPAC nameN-[(4R)-4-(3,4-dimethoxyphenyl)-4-[1,3-dioxo-4-[4-[(1R)-1-phenylethyl]piperazin-1-yl]isoindol-2-yl]butyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
Molecular weight664.807
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP5.0
SynonymsSCHEMBL1472946
BDBM50302254
N-((R)-4-(3,4-dimethoxyphenyl)-4-(1,3-dioxo-4-(4-((R)-1-phenylethyl)piperazin-1-yl)isoindolin-2-yl)butyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
Inchi KeyCZWJHNWGEGYHNZ-PDDLMNHVSA-N
Inchi IDInChI=1S/C38H44N6O5/c1-24-34(25(2)41-40-24)36(45)39-18-10-15-30(28-16-17-32(48-4)33(23-28)49-5)44-37(46)29-13-9-14-31(35(29)38(44)47)43-21-19-42(20-22-43)26(3)27-11-7-6-8-12-27/h6-9,11-14,16-17,23,26,30H,10,15,18-22H2,1-5H3,(H,39,45)(H,40,41)/t26-,30-/m1/s1
PubChem CID44596967
ChEMBLCHEMBL565388
IUPHARN/A
BindingDB50302254
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
54723Urotensin-2 receptorP49684Uts2rRattus norvegicus (Rat)386
54724Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389

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