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Ligand

NameCHEMBL3908495
Molecular formulaC28H34F5N3O2
IUPAC name(3R,4S)-N-[3-(difluoromethyl)-5-(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-4-methyl-3-[[methyl(2-methylpropyl)amino]methyl]-5-oxopyrrolidine-3-carboxamide
Molecular weight539.591
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.8
SynonymsSCHEMBL15251238
Inchi KeyLAZGCGKIBDFSLJ-XHCCPWGMSA-N
Inchi IDInChI=1S/C28H34F5N3O2/c1-16(2)13-35(6)14-27(15-36(25(37)19(27)5)23-17(3)8-7-9-18(23)4)26(38)34-22-11-20(24(29)30)10-21(12-22)28(31,32)33/h7-12,16,19,24H,13-15H2,1-6H3,(H,34,38)/t19-,27-/m1/s1
PubChem CID89799862
ChEMBLCHEMBL3908495
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
540664Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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