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Ligand

NameMLS001105136
Molecular formulaC20H29N3O4S
IUPAC name4-[4-[(1S,4S)-2-azabicyclo[2.2.1]heptane-2-carbonyl]phenoxy]-N,N-dimethylpiperidine-1-sulfonamide
Molecular weight407.529
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP2.0
SynonymsMCULE-6863026789
SMR000658171
CHEMBL1380154
4-{4-[(1S*,4S*)-2-azabicyclo[2.2.1]hept-2-ylcarbonyl]phenoxy}-N,N-dimethyl-1-piperidinesulfonamide
ZINC100917981
[ Show all ]
Inchi KeyAHQPFGVMHJJOQX-RDJZCZTQSA-N
Inchi IDInChI=1S/C20H29N3O4S/c1-21(2)28(25,26)22-11-9-19(10-12-22)27-18-7-4-16(5-8-18)20(24)23-14-15-3-6-17(23)13-15/h4-5,7-8,15,17,19H,3,6,9-14H2,1-2H3/t15-,17-/m0/s1
PubChem CID24791674
ChEMBLCHEMBL1380154
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
463582Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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