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Ligand

NameSCHEMBL1432281
Molecular formulaC29H34ClN3O
IUPAC name5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-N-[(1S)-1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl]pyrazole-3-carboxamide
Molecular weight476.061
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP7.4
SynonymsN-(1,3,3-trimethylbicyclo(2.2.1)heptan-2-yl)-5-(4-chloro-3-methylphenyl)-1-(4-methylbenzyl)pyrazole-3-carboxamide
5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-N-[(1S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-yl]-1H-pyrazole-3-carboxamide
PDSP1_001328
BDBM21280
PDSP2_001312
Inchi KeySUGVYNSRNKFXQM-ACSDJOOWSA-N
Inchi IDInChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)/t22?,27?,29-/m0/s1
PubChem CID21310426
ChEMBLN/A
IUPHARN/A
BindingDB21280
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 45
Page:  / 3 

GLASS IDNameUniProtGeneSpeciesLength
3233905-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
3233815-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
3233805-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
3233915-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5567855-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388
556775Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
556782Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
556779Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
323382Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
323376B1 bradykinin receptorP46663BDKRB1Homo sapiens (Human)353
556774B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
323392Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
556789Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
323369Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
323371Cannabinoid receptor 1P47746Cnr1Mus musculus (Mouse)473
323378Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
323368Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
323383Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347
556781Cannabinoid receptor 2Q9QZN9Cnr2Rattus norvegicus (Rat)360
323387D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446

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