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Ligand

NameAC1LDFVB
Molecular formulaC13H7Cl2N3O3
IUPAC name3-[2-(3,5-dichloro-1,2,4-triazol-1-yl)acetyl]chromen-2-one
Molecular weight324.117
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.6
SynonymsA3872/0164521
MCULE-3415378862
2H-1-Benzopyran-2-one, 3-[2-(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]-
AKOS003366316
SMR000035798
[ Show all ]
Inchi KeyACIJLVMBHSTHLJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H7Cl2N3O3/c14-12-16-13(15)18(17-12)6-9(19)8-5-7-3-1-2-4-10(7)21-11(8)20/h1-5H,6H2
PubChem CID666386
ChEMBLCHEMBL1462825
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
1610Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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