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Ligand

NameMLS000420322
Molecular formulaC24H28ClN5O5
IUPAC name3-[[2-(4-chlorophenyl)acetyl]amino]-3-[3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]propanamide
Molecular weight501.968
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.4
SynonymsHMS3352N18
CHEMBL1437255
HMS2203O16
SMR000463231
Inchi KeyALGCGZMAHOHBFT-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H28ClN5O5/c25-18-7-4-16(5-8-18)13-23(32)28-20(15-22(26)31)17-6-9-19(21(14-17)30(34)35)27-10-2-12-29-11-1-3-24(29)33/h4-9,14,20,27H,1-3,10-13,15H2,(H2,26,31)(H,28,32)
PubChem CID24789160
ChEMBLCHEMBL1437255
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8237Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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