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Ligand

NameCHEMBL3401377
Molecular formulaC24H30ClFN2O3
IUPAC nameN-[3-chloro-5-(4-fluorophenoxy)phenyl]-4-(2-ethylbutyl)-4-hydroxypiperidine-1-carboxamide
Molecular weight448.963
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP5.8
SynonymsBDBM50065604
Inchi KeyCAQJBFDNASWNMC-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H30ClFN2O3/c1-3-17(4-2)16-24(30)9-11-28(12-10-24)23(29)27-20-13-18(25)14-22(15-20)31-21-7-5-19(26)6-8-21/h5-8,13-15,17,30H,3-4,9-12,16H2,1-2H3,(H,27,29)
PubChem CID118728426
ChEMBLCHEMBL3401377
IUPHARN/A
BindingDB50065604
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
443168Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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