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Ligand

NameCHEMBL3926348
Molecular formulaC31H35F6N3O4
IUPAC nametert-butyl 4-[3-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-1-(2,6-dimethylphenyl)-5-oxopyrrolidin-3-yl]piperidine-1-carboxylate
Molecular weight627.628
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP5.8
SynonymsSCHEMBL12728459
Inchi KeyHUQGOWJXRXYNBV-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H35F6N3O4/c1-18-7-6-8-19(2)25(18)40-17-29(16-24(40)41,20-9-11-39(12-10-20)27(43)44-28(3,4)5)26(42)38-23-14-21(30(32,33)34)13-22(15-23)31(35,36)37/h6-8,13-15,20H,9-12,16-17H2,1-5H3,(H,38,42)
PubChem CID51033568
ChEMBLCHEMBL3926348
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
539090Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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