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Ligand

NameSCHEMBL1989445
Molecular formulaC31H37ClFN3O5
IUPAC name(4-fluorophenyl) N-[(3S,4R)-4-(4-chlorophenyl)-1-[1-(oxane-4-carbonyl)piperidine-4-carbonyl]pyrrolidin-3-yl]-N-ethylcarbamate
Molecular weight586.101
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.1
SynonymsUS9346786, 97
CHEMBL3946816
BDBM233293
Inchi KeyAUUPZFZZCRPIRL-WUFINQPMSA-N
Inchi IDInChI=1S/C31H37ClFN3O5/c1-2-36(31(39)41-26-9-7-25(33)8-10-26)28-20-35(19-27(28)21-3-5-24(32)6-4-21)30(38)22-11-15-34(16-12-22)29(37)23-13-17-40-18-14-23/h3-10,22-23,27-28H,2,11-20H2,1H3/t27-,28+/m0/s1
PubChem CID58312644
ChEMBLCHEMBL3946816
IUPHARN/A
BindingDB233293
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
536375Neuromedin-K receptorP29371TACR3Homo sapiens (Human)465

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