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Ligand

NameCHEMBL3941195
Molecular formulaC25H27F6N3O2
IUPAC name(3R,4S)-N-[3,5-bis(trifluoromethyl)phenyl]-3-[(dimethylamino)methyl]-1-(2,6-dimethylphenyl)-4-methyl-5-oxopyrrolidine-3-carboxamide
Molecular weight515.5
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP4.8
SynonymsSCHEMBL15251223
Inchi KeyKEIRCJWVHDGZCL-WAIKUNEKSA-N
Inchi IDInChI=1S/C25H27F6N3O2/c1-14-7-6-8-15(2)20(14)34-13-23(12-33(4)5,16(3)21(34)35)22(36)32-19-10-17(24(26,27)28)9-18(11-19)25(29,30)31/h6-11,16H,12-13H2,1-5H3,(H,32,36)/t16-,23-/m1/s1
PubChem CID51034567
ChEMBLCHEMBL3941195
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
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GLASS IDNameUniProtGeneSpeciesLength
540270Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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