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Ligand

NameCHEMBL551383
Molecular formulaC21H24ClN7O3
IUPAC name2-[2-[[5-[(4-chlorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]-4,6-dioxo-1,3,5-triazin-2-yl]amino]ethyl]guanidine
Molecular weight457.919
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP1.3
SynonymsBDBM50294596
1-(2-(5-(4-chlorobenzyl)-1-(4-methoxybenzyl)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-ylamino)ethyl)guanidine
Inchi KeyHUCPDEBWEDCMEX-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24ClN7O3/c1-32-17-8-4-15(5-9-17)12-28-19(26-11-10-25-18(23)24)27-20(30)29(21(28)31)13-14-2-6-16(22)7-3-14/h2-9H,10-13H2,1H3,(H4,23,24,25)(H,26,27,30)
PubChem CID11951031
ChEMBLCHEMBL551383
IUPHARN/A
BindingDB50294596
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
124187Prokineticin receptor 1Q8TCW9PROKR1Homo sapiens (Human)393

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