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Ligand

NameAbt-418
Molecular formulaC9H14N2O
IUPAC name3-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2-oxazole
Molecular weight166.224
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP1.2
SynonymsAbt 418
147402-53-7
3-methyl-5-(1-methyl-2-pyrrolidinyl)isoxazole
CHEMBL274525
(S)-3-Methyl-5-(1-methyl-2-pyrrolidinyl)isoxazole
[ Show all ]
Inchi KeyILLGYRJAYAAAEW-QMMMGPOBSA-N
Inchi IDInChI=1S/C9H14N2O/c1-7-6-9(12-10-7)8-4-3-5-11(8)2/h6,8H,3-5H2,1-2H3/t8-/m0/s1
PubChem CID119380
ChEMBLN/A
IUPHARN/A
BindingDB50035398
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: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1360845-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
460457Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
556005Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
460456Beta-2 adrenergic receptorP18762Adrb2Mus musculus (Mouse)418
136087D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
556006D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
556007Gamma-aminobutyric acid type B receptor subunit 1Q9UBS5GABBR1Homo sapiens (Human)961
136088Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
136086Muscarinic acetylcholine receptor M1P12657Chrm1Mus musculus (Mouse)460
460458Substance-K receptorP05363TACR2Bos taurus (Bovine)384
460459Substance-P receptorP25103TACR1Homo sapiens (Human)407
136085Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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