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Ligand

NameCHEMBL392688
Molecular formulaC27H32F2N4O2
IUPAC name1-[(2,6-difluorophenyl)methyl]-3-[2-(dimethylamino)ethyl]-6-[(4-ethylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione
Molecular weight482.576
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.3
Synonyms1-(2,6-difluorobenzyl)-6-(4-ethylbenzyl)-3-(2-(dimethylamino)ethyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4(1H,3H)-dione
BDBM50215171
Inchi KeyBJQJIQFGCVMLRR-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H32F2N4O2/c1-4-19-8-10-20(11-9-19)16-31-13-12-25-22(17-31)26(34)32(15-14-30(2)3)27(35)33(25)18-21-23(28)6-5-7-24(21)29/h5-11H,4,12-18H2,1-3H3
PubChem CID44435994
ChEMBLCHEMBL392688
IUPHARN/A
BindingDB50215171
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
25366Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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