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SMILES: CCCCCCCCCCOc1cccc(Cn2ccc(O)c(C(O)=O)c2=O)c1

InChI Key: InChIKey=GUODRJBQCSNTCX-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50388907   
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
4,4'-diapophytoene synthase


(Staphylococcus aureus)		BDBM50388907
PNG
(CHEMBL2063257)
Show SMILES CCCCCCCCCCOc1cccc(Cn2ccc(O)c(C(O)=O)c2=O)c1
Show InChI InChI=1S/C23H31NO5/c1-2-3-4-5-6-7-8-9-15-29-19-12-10-11-18(16-19)17-24-14-13-20(25)21(22(24)26)23(27)28/h10-14,16,25H,2-9,15,17H2,1H3,(H,27,28)
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Similars
Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus His6-tagged CrtM expressed in Escherichia coli BL21(DE3) using Farnesyl pyrophosphate as substrate incubated for ...

ACS Med Chem Lett 3: 402-406 (2012)


Article DOI: 10.1021/ml300038t
BindingDB Entry DOI: 10.7270/Q2XW4KVQ
More data for this
Ligand-Target Pair		3D
3D Structure (docked)