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BDBM50421637 CHEMBL2303826

SMILES: CO[C@@H]1O[C@H]([C@@H](O[C@H]2OC(COS(O)(=O)=O)=C[C@H](OS(O)(=O)=O)[C@H]2NS(O)(=O)=O)[C@H](O)[C@H]1OS(O)(=O)=O)C(O)=O

InChI Key: InChIKey=IPQPDAVGKFYCKY-MGPPVRRBSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50421637   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X/antithrombin III


(Homo sapiens (human))
BDBM50421637
PNG
(CHEMBL2303826)
Show SMILES CO[C@@H]1O[C@H]([C@@H](O[C@H]2OC(COS(O)(=O)=O)=C[C@H](OS(O)(=O)=O)[C@H]2NS(O)(=O)=O)[C@H](O)[C@H]1OS(O)(=O)=O)C(O)=O
Show InChI InChI=1S/C13H21NO22S4/c1-30-13-9(36-40(27,28)29)7(15)8(10(34-13)11(16)17)33-12-6(14-37(18,19)20)5(35-39(24,25)26)2-4(32-12)3-31-38(21,22)23/h2,5-10,12-15H,3H2,1H3,(H,16,17)(H,18,19,20)(H,21,22,23)(H,24,25,26)(H,27,28,29)/t5-,6+,7-,8-,9+,10+,12+,13+/m0/s1
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PC cid
PC sid
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Similars

PubMed
n/an/an/a 9.50E+4n/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Equilibrium dissociation constant of factor Xa inhibition


Citation and Details
More data for this
Ligand-Target Pair