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Ligand

NameCHEMBL1096742
Molecular formulaC15H36N9O13P3
IUPAC nameazane;[[(2R,3S,4R,5R)-5-[6-(cyclopentylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight643.424
Hydrogen bond acceptor21
Hydrogen bond donor11
XlogPNone
SynonymsN/A
Inchi KeyHLTBXXMFICXFOB-GLBHFFKESA-N
Inchi IDInChI=1S/C15H24N5O13P3.4H3N/c21-11-9(5-30-35(26,27)33-36(28,29)32-34(23,24)25)31-15(12(11)22)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8;;;;/h6-9,11-12,15,21-22H,1-5H2,(H,26,27)(H,28,29)(H,16,17,19)(H2,23,24,25);4*1H3/t9-,11-,12-,15-;;;;/m1..../s1
PubChem CID49797719
ChEMBLCHEMBL1096742
IUPHARN/A
BindingDBN/A
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.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
118210Uracil nucleotide/cysteinyl leukotriene receptorQ13304GPR17Homo sapiens (Human)367

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