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BDBM50487147 AZOXYSTROBIN::CHEBI:40909::DNDI1511705::TCMDC-125883

SMILES: CO\C=C(\C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1

InChI Key: InChIKey=WFDXOXNFNRHQEC-GHRIWEEISA-N

Data: 1 KI

PDB links: 4 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50487147   
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
Cytochrome b


(Sus scrofa)
BDBM50487147
PNG
(AZOXYSTROBIN | CHEBI:40909 | DNDI1511705 | TCMDC-1...)
Show SMILES CO\C=C(\C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1
Show InChI InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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DrugBank
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MCE
KEGG
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
298n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Sus scrofa (pig) heart cytochrome bc1 complex using DBH2 as substrate by spectrophotometric analysis


J Am Chem Soc 132: 185-94 (2010)


Article DOI: 10.1021/ja905756c
BindingDB Entry DOI: 10.7270/Q27W6G35
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)