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BDBM50160803 4,4''-Dimethoxy-9,10,9'',10''-tetrahydro-[1,3'']biphenanthrenyl-2,7,2'',7''-tetraol::CHEMBL185178

SMILES: COc1cc(O)c(c2CCc3cc(O)ccc3-c12)-c1c(O)cc2CCc3cc(O)ccc3-c2c1OC

InChI Key: InChIKey=SRKMCQJMXFPIDU-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50160803   
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
Beta tubulin


(Leishmania donovani)
BDBM50160803
PNG
(4,4''-Dimethoxy-9,10,9'',10''-tetrahydro-[1,3'']bi...)
Show SMILES COc1cc(O)c(c2CCc3cc(O)ccc3-c12)-c1c(O)cc2CCc3cc(O)ccc3-c2c1OC |(-6.97,.26,;-5.64,1.03,;-4.31,.27,;-4.31,-1.28,;-2.98,-2.05,;-2.98,-3.58,;-1.65,-1.28,;-1.65,.26,;-.32,1.03,;-.3,2.56,;-1.63,3.33,;-1.6,4.85,;-2.93,5.65,;-2.93,7.18,;-4.29,4.89,;-4.31,3.35,;-2.98,2.57,;-2.98,1.04,;-.32,-2.05,;-.32,-3.59,;-1.65,-4.36,;1.01,-4.36,;2.34,-3.59,;3.67,-4.36,;5.02,-3.59,;5.02,-2.05,;6.38,-1.27,;6.38,.28,;7.73,1.05,;5.02,1.07,;3.69,.3,;3.69,-1.26,;2.34,-2.05,;1.01,-1.27,;1.01,.26,;2.34,1.03,)|
Show InChI InChI=1S/C30H26O6/c1-35-25-14-24(34)28(22-8-5-16-12-19(32)7-10-21(16)27(22)25)29-23(33)13-17-4-3-15-11-18(31)6-9-20(15)26(17)30(29)36-2/h6-7,9-14,31-34H,3-5,8H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization interacting at the colchicine binding site.


Bioorg Med Chem Lett 15: 1051-4 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.026
BindingDB Entry DOI: 10.7270/Q22Z151S
More data for this
Ligand-Target Pair