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Ligand

NameCHEMBL118007
Molecular formulaC16H20N3O11P3
IUPAC name[2-[[3,5-bis(phosphonomethyl)phenyl]diazenyl]-4-formyl-5-hydroxy-6-methylpyridin-3-yl]methylphosphonic acid
Molecular weight523.267
Hydrogen bond acceptor14
Hydrogen bond donor7
XlogP-3.1
SynonymsSCHEMBL14702230
BDBM50102297
[2-(3,5-Bis-phosphonomethyl-phenylazo)-4-formyl-5-hydroxy-6-methyl-pyridin-3-ylmethyl]-phosphonic acid
2-[3,5-Bis(phosphonomethyl)phenylazo]-3-(phosphonomethyl)-5-hydroxy-6-methylpyridine-4-carbaldehyde
Inchi KeyAKJAONLVCOKUIC-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H20N3O11P3/c1-9-15(21)13(5-20)14(8-33(28,29)30)16(17-9)19-18-12-3-10(6-31(22,23)24)2-11(4-12)7-32(25,26)27/h2-5,21H,6-8H2,1H3,(H2,22,23,24)(H2,25,26,27)(H2,28,29,30)
PubChem CID135475353
ChEMBLN/A
IUPHARN/A
BindingDB50102297
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
557505P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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