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Ligand

NameSurinabant
Molecular formulaC23H23BrCl2N4O
IUPAC name5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-N-piperidin-1-ylpyrazole-3-carboxamide
Molecular weight522.268
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP7.0
SynonymsNCGC00254070-01
Tox21_300239
BDBM50171290
DSSTox_CID_27357
DTXSID2047357
[ Show all ]
Inchi KeyHMXDWDSNPRNUKI-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H23BrCl2N4O/c1-2-18-21(23(31)28-29-12-4-3-5-13-29)27-30(20-11-10-17(25)14-19(20)26)22(18)15-6-8-16(24)9-7-15/h6-11,14H,2-5,12-13H2,1H3,(H,28,31)
PubChem CID9849616
ChEMBLCHEMBL189676
IUPHAR9233
BindingDB50171290
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 51
Page:  / 3 

GLASS IDNameUniProtGeneSpeciesLength
1190565-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1190625-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1190595-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
1190745-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5559465-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388
4602985-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
5559495-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
555950Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
555941Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
555948Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
119064Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
460302Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
119065Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
119076Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
555945Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
119058Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
119075Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
119060Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
119082D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
119068D(1B) dopamine receptorP21918DRD5Homo sapiens (Human)477

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