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BDBM50303425 4-(phenylamino)-6-(propylamino)-1,3,5-triazine-2-carbonitrile::CHEMBL576847

SMILES: CCCNc1nc(Nc2ccccc2)nc(n1)C#N

InChI Key: InChIKey=JRWWHYZJMVVZID-UHFFFAOYSA-N

Data: 1 IC50

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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 = 50303425   
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
Cruzipain


(Trypanosoma cruzi)
BDBM50303425
PNG
(4-(phenylamino)-6-(propylamino)-1,3,5-triazine-2-c...)
Show SMILES CCCNc1nc(Nc2ccccc2)nc(n1)C#N
Show InChI InChI=1S/C13H14N6/c1-2-8-15-12-17-11(9-14)18-13(19-12)16-10-6-4-3-5-7-10/h3-7H,2,8H2,1H3,(H2,15,16,17,18,19)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 790n/an/an/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Trypanosoma cruzi cruzain after 15 mins


J Med Chem 53: 52-60 (2010)


Article DOI: 10.1021/jm901069a
BindingDB Entry DOI: 10.7270/Q2TX3FG5
More data for this
Ligand-Target Pair