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Ligand

NameCHEMBL1760338
Molecular formulaC21H21ClN4O2
IUPAC name[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
Molecular weight396.875
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.9
Synonyms(3-(4-chlorophenyl)-1H-pyrazol-5-yl)(4-(2-methoxyphenyl)piperazin-1-yl)methanone
1-{[3-(4-chlorophenyl)-1H-pyrazol-5-yl]carbonyl}-4-(2-methoxyphenyl)piperazine
AKOS001920631
AKOS005636717
BDBM50341075
[ Show all ]
Inchi KeyDEYOMMQLWMIBRN-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21ClN4O2/c1-28-20-5-3-2-4-19(20)25-10-12-26(13-11-25)21(27)18-14-17(23-24-18)15-6-8-16(22)9-7-15/h2-9,14H,10-13H2,1H3,(H,23,24)
PubChem CID20906619
ChEMBLCHEMBL1760338
IUPHARN/A
BindingDB50341075
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
58280Neuromedin-K receptorP29371TACR3Homo sapiens (Human)465
58282Neuromedin-K receptorP16177Tacr3Rattus norvegicus (Rat)452
58281Substance-K receptorP21452TACR2Homo sapiens (Human)398
58279Substance-P receptorP25103TACR1Homo sapiens (Human)407

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