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Ligand

NameCHEMBL238066
Molecular formulaC33H43ClN4O5
IUPAC nametert-butyl 4-[[[5-chloro-2-[1-[2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl]benzoyl]amino]methyl]piperidine-1-carboxylate
Molecular weight611.18
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
SynonymsSCHEMBL4428971
BDBM50224724
tert-butyl 4-((5-chloro-2-(1-(2-(3-oxo-2,3-dihydrobenzo[b][1,4]oxazin-4-yl)ethyl)piperidin-4-yl)benzamido)methyl)piperidine-1-carboxylate
Inchi KeyAZZYTBNDKWLIQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H43ClN4O5/c1-33(2,3)43-32(41)37-16-10-23(11-17-37)21-35-31(40)27-20-25(34)8-9-26(27)24-12-14-36(15-13-24)18-19-38-28-6-4-5-7-29(28)42-22-30(38)39/h4-9,20,23-24H,10-19,21-22H2,1-3H3,(H,35,40)
PubChem CID24804491
ChEMBLCHEMBL238066
IUPHARN/A
BindingDB50224724
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
18655Urotensin-2 receptorP49684Uts2rRattus norvegicus (Rat)386
18656Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389

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