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Compile Data Set for Download or QSAR

Found 1 hit of ec50 data for polymerid = 5707   
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
LecB


(Pseudomonas aeruginosa)
BDBM103982
PNG
(LecB Inhibitor Ligand 6)
Show SMILES CC1O[C@@H](OCCNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](O)C(O)[C@@H]1O
Show InChI InChI=1S/C29H28N2O10S/c1-13-24(34)25(35)26(36)28(40-13)39-9-8-30-29(42)31-14-2-5-17(20(10-14)27(37)38)23-18-6-3-15(32)11-21(18)41-22-12-16(33)4-7-19(22)23/h2-7,10-13,24-26,28,32,34-36H,8-9H2,1H3,(H,37,38)(H2,30,31,42)/t13?,24-,25?,26+,28-/m1/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.74E+3n/a 697n/an/an/an/a



University of Konstanz





ACS Chem Biol 8: 1775-84 (2013)

More data for this
Ligand-Target Pair