Details of the Drug

General Information of Drug (ID: DME15MN)

Drug Name
Lys-thiol
Synonyms 6-Amino-2-mercapto-hexanoic acid; CHEMBL432852; Lys-thiol; GTPL8667; SCHEMBL11506085; 6-amino-2-sulfanylhexanoic acid; BDBM50036831
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL is unavailable 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 163.24
Logarithm of the Partition Coefficient (xlogp) -2
Rotatable Bond Count (rotbonds) 5
Hydrogen Bond Donor Count (hbonddonor) 3
Hydrogen Bond Acceptor Count (hbondacc) 4
Chemical Identifiers
Formula
C6H13NO2S
IUPAC Name
6-amino-2-sulfanylhexanoic acid
Canonical SMILES
C(CCN)CC(C(=O)O)S
InChI
InChI=1S/C6H13NO2S/c7-4-2-1-3-5(10)6(8)9/h5,10H,1-4,7H2,(H,8,9)
InChIKey
JNQDJHCXDRGZJD-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
20384324
TTD ID
D02BLC

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Arginyl aminopeptidase (RNPEP) TTD74YX AMPB_HUMAN Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 L-lysinethiol: a subnanomolar inhibitor of aminopeptidase B. Biochem Biophys Res Commun. 1987 Jun 30;145(3):1038-42.