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Ligand

NameAC1MVU2C
Molecular formulaC19H27ClFN3O3S
IUPAC nameN-[(2-chloro-4-fluorophenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide
Molecular weight431.951
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.7
SynonymsMCULE-8722734812
N-(2-chloro-4-fluorobenzyl)-1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-4-carboxamide
UNM000000890601
MLS001031087
N-[(2-chloro-4-fluorophenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide
[ Show all ]
Inchi KeyAFDLYVOVJSFPIL-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H27ClFN3O3S/c1-14-4-8-23(9-5-14)28(26,27)24-10-6-15(7-11-24)19(25)22-13-16-2-3-17(21)12-18(16)20/h2-3,12,14-15H,4-11,13H2,1H3,(H,22,25)
PubChem CID3688968
ChEMBLCHEMBL1874298
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463379Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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