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SMILES: NC(=O)CC[C@@H]([NH3+])CS

InChI Key: InChIKey=OAMVCWOFTPKCOT-SCSAIBSYSA-O

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50073672   
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
Tetanus toxin


(Clostridium tetani)		BDBM50073672
PNG
((R)-3-Carbamoyl-1-mercaptomethyl-propyl-ammonium)
Show SMILES NC(=O)CC[C@@H]([NH3+])CS
Show InChI InChI=1S/C5H12N2OS/c6-4(3-9)1-2-5(7)8/h4,9H,1-3,6H2,(H2,7,8)/p+1/t4-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
 2.50E+5n/an/an/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of tetanus neurotoxin (TeNt)

J Med Chem 42: 515-25 (1999)


Article DOI: 10.1021/jm981066w
BindingDB Entry DOI: 10.7270/Q2BC4075
More data for this
Ligand-Target Pair