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Ligand

NameCHEMBL3896219
Molecular formulaC17H15N7OS
IUPAC name4-[(8S)-8-methyl-3-(3-methyl-1,2,4-thiadiazol-5-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]benzonitrile
Molecular weight365.415
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP1.2
SynonymsN/A
Inchi KeyBYTHHHFQHHITDO-JTQLQIEISA-N
Inchi IDInChI=1S/C17H15N7OS/c1-10-14-20-21-15(16-19-11(2)22-26-16)24(14)8-7-23(10)17(25)13-5-3-12(9-18)4-6-13/h3-6,10H,7-8H2,1-2H3/t10-/m0/s1
PubChem CID134133839
ChEMBLCHEMBL3896219
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548309Neuromedin-K receptorP29371TACR3Homo sapiens (Human)465
548308Substance-K receptorP21452TACR2Homo sapiens (Human)398
548310Substance-P receptorP25103TACR1Homo sapiens (Human)407

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