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Ligand

NameMLS002276465
Molecular formulaC20H15ClN4
IUPAC name6-(2-chlorophenyl)-N-(pyridin-3-ylmethyl)quinazolin-4-amine
Molecular weight346.818
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
SynonymsSMR001318006
6-(2-chlorophenyl)-N-(pyridin-3-ylmethyl)quinazolin-4-amine
NCGC00011606
AC1MM6ZU
CHEMBL1480806
[ Show all ]
Inchi KeyAFIBHUSAXJIJHX-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15ClN4/c21-18-6-2-1-5-16(18)15-7-8-19-17(10-15)20(25-13-24-19)23-12-14-4-3-9-22-11-14/h1-11,13H,12H2,(H,23,24,25)
PubChem CID3234184
ChEMBLCHEMBL1480806
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
4172Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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