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Ligand

NameCHEMBL104985
Molecular formulaC14H18ClN3O
IUPAC name5-chloro-7-methyl-2-(4-methyl-1,4-diazepan-1-yl)-1,3-benzoxazole
Molecular weight279.768
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.4
SynonymsSCHEMBL2743725
HUKVXBOLNLWFQV-UHFFFAOYSA-N
BDBM50066000
5-chloro-7-methyl-2-(4-methyl-1-homopiperazinyl)benzoxazole
5-Chloro-7-methyl-2-(4-methyl-[1,4]diazepan-1-yl)-benzooxazole
[ Show all ]
Inchi KeyHUKVXBOLNLWFQV-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H18ClN3O/c1-10-8-11(15)9-12-13(10)19-14(16-12)18-5-3-4-17(2)6-7-18/h8-9H,3-7H2,1-2H3
PubChem CID9795675
ChEMBLCHEMBL104985
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: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1244155-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
1244135-hydroxytryptamine receptor 1FP30940Htr1fRattus norvegicus (Rat)366
1244185-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
1244145-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388
124419Adenosine receptor A2bP29276Adora2bRattus norvegicus (Rat)332
124412Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450
124411Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415
124416D(1A) dopamine receptorQ61616Drd1Mus musculus (Mouse)446
124410D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
124417Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589

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