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Ligand

NameCHEMBL542064
Molecular formulaC9H12N2O2
IUPAC namebut-2-ynyl 1,4,5,6-tetrahydropyrimidine-5-carboxylate
Molecular weight180.207
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP-0.3
Synonyms1,4,5,6-Tetrahydro-pyrimidine-5-carboxylic acid but-2-ynyl ester; hydrochloride
BDBM50057400
OCYKJDHYLRHMDX-UHFFFAOYSA-N
5-(2-butynyloxycarbonyl)-1,4,5,6-tetrahydropyrimidine
CHEMBL1191028
[ Show all ]
Inchi KeyOCYKJDHYLRHMDX-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H12N2O2/c1-2-3-4-13-9(12)8-5-10-7-11-6-8/h7-8H,4-6H2,1H3,(H,10,11)
PubChem CID10607458
ChEMBLN/A
IUPHARN/A
BindingDB50057400
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
238136Muscarinic acetylcholine receptor M1P12657Chrm1Mus musculus (Mouse)460

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