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Ligand

NameCHEMBL3889563
Molecular formulaC18H24ClN3O4S
IUPAC name4-[(4-chloro-2-methoxyphenyl)methyl]-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-ol
Molecular weight413.917
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.4
SynonymsBDBM250610
JDTHPTFPMSSAJL-UHFFFAOYSA-N
SCHEMBL15549096
4-(4-Chloro-2-methoxybenzyl)-1-((3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl)piperidin-4-ol
US9475795, 89
Inchi KeyJDTHPTFPMSSAJL-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H24ClN3O4S/c1-12-17(13(2)21-20-12)27(24,25)22-8-6-18(23,7-9-22)11-14-4-5-15(19)10-16(14)26-3/h4-5,10,23H,6-9,11H2,1-3H3,(H,20,21)
PubChem CID72551112
ChEMBLCHEMBL3889563
IUPHARN/A
BindingDB250610
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
534571Prokineticin receptor 1Q8TCW9PROKR1Homo sapiens (Human)393

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