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Ligand

NameBDBM50006101
Molecular formulaC30H54N2O6PS-
IUPAC name(3-hexadecoxy-2-methoxypropyl) [3-[[methyl(methylcarbamothioyl)amino]methyl]phenyl] phosphate
Molecular weight601.804
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP8.0
SynonymsPhosphoric acid 3-(1,3-dimethyl-thioureidomethyl)-phenyl ester 3-hexadecyloxy-2-methoxy-propyl ester
Inchi KeyBKVKNCLEONYSIM-UHFFFAOYSA-M
Inchi IDInChI=1S/C30H55N2O6PS/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-36-25-29(35-4)26-37-39(33,34)38-28-21-19-20-27(23-28)24-32(3)30(40)31-2/h19-21,23,29H,5-18,22,24-26H2,1-4H3,(H,31,40)(H,33,34)/p-1
PubChem CID44290597
ChEMBLN/A
IUPHARN/A
BindingDB50006101
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
519816Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342

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