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Ligand

NameAC1NHSUN
Molecular formulaC22H32N2O5S
IUPAC nameethyl 4-[4-(cyclohexylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate
Molecular weight436.567
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.4
SynonymsAB00734454-01
MCULE-3594684923
SMR001245077
ethyl 4-[4-(cyclohexylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate
MLS002162677
[ Show all ]
Inchi KeyAEXMFNJUMIYYOG-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H32N2O5S/c1-2-29-22(26)19-8-10-20(11-9-19)30(27,28)24-14-12-18(13-15-24)21(25)23-16-17-6-4-3-5-7-17/h8-11,17-18H,2-7,12-16H2,1H3,(H,23,25)
PubChem CID4795147
ChEMBLCHEMBL1707639
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
463361Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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