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Ligand

NameCHEMBL1094760
Molecular formulaC10H14ClN5O9P2
IUPAC name[(2R,3S,5R)-5-(6-amino-2-chloropurin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate
Molecular weight445.646
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogP-2.0
SynonymsCHEMBL1199057
BDBM50318028
2-Chloro-2'-deoxyadenosine 3',5'-bisphosphoric acid
diammonium (2R,3S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-2-[(hydrogen phosphonatooxy)methyl]oxolan-3-yl hydrogen phosphate
Inchi KeyFCTUCHUTNSXNIZ-KVQBGUIXSA-N
Inchi IDInChI=1S/C10H14ClN5O9P2/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(25-27(20,21)22)5(24-6)2-23-26(17,18)19/h3-6H,1-2H2,(H2,12,14,15)(H2,17,18,19)(H2,20,21,22)/t4-,5+,6+/m0/s1
PubChem CID10671020
ChEMBLCHEMBL1199057
IUPHARN/A
BindingDB50318028
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
75225P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362
75224Uracil nucleotide/cysteinyl leukotriene receptorQ13304GPR17Homo sapiens (Human)367

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