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Ligand

NameCHEMBL1934421
Molecular formulaC25H36F3N5O3S
IUPAC nameN-[(2S)-3,3-dimethylbutan-2-yl]-3-methyl-5-[(4-methylphenyl)sulfonylamino]-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyrazole-4-carboxamide
Molecular weight543.65
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP5.4
SynonymsBDBM50419564
Inchi KeyASROBFZJWMKUSD-SFHVURJKSA-N
Inchi IDInChI=1S/C25H36F3N5O3S/c1-16-7-9-20(10-8-16)37(35,36)31-22-21(23(34)29-18(3)24(4,5)6)17(2)30-33(22)19-11-13-32(14-12-19)15-25(26,27)28/h7-10,18-19,31H,11-15H2,1-6H3,(H,29,34)/t18-/m0/s1
PubChem CID57399614
ChEMBLCHEMBL1934421
IUPHARN/A
BindingDB50419564
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
13466fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350

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