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Ligand

NameCHEMBL235519
Molecular formulaC31H35ClF2N4O2
IUPAC name6-[(4-chlorophenyl)methyl]-3-[[(2R)-1-cyclopentylpyrrolidin-2-yl]methyl]-1-[(2,6-difluorophenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione
Molecular weight569.094
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP5.0
Synonyms(R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-((1-cyclopentylpyrrolidin-2-yl)methyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4(1H,3H)-dione
BDBM50215189
Inchi KeyAUTSCZOWVXPUGG-XMMPIXPASA-N
Inchi IDInChI=1S/C31H35ClF2N4O2/c32-22-12-10-21(11-13-22)17-35-16-14-29-26(19-35)30(39)38(18-24-7-4-15-36(24)23-5-1-2-6-23)31(40)37(29)20-25-27(33)8-3-9-28(25)34/h3,8-13,23-24H,1-2,4-7,14-20H2/t24-/m1/s1
PubChem CID44436014
ChEMBLCHEMBL235519
IUPHARN/A
BindingDB50215189
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14986Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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