LM10

Ligand id: 9016

Name: LM10

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 70.25
Molecular weight 229.08
XLogP 2.55
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
6-fluoro-3-[(E)-2-(1H-1,2,3,4-tetrazol-5-yl)ethenyl]-1H-indole
Synonyms
LM-10
Comments
LM10 is an experimental compound reported as an inhibitor of tryptophan 2,3-dioxygenase (TDO2), with anti-neoplastic activity in a murine syngeneic tumour model [1-2].
The closest structural match on PubChem (CID 91885138) is an alternative representation, with different double bond specification across the vinyl group linking the indole and tetrazole groups.
Database Links
ChEMBL Ligand CHEMBL1812545
GtoPdb PubChem SID 315661101
PubChem CID 91885138
Search Google for chemical match using the InChIKey JDBSZVDIUIRSDG-DAFODLJHSA-N
Search Google for chemicals with the same backbone JDBSZVDIUIRSDG
Search UniChem for chemical match using the InChIKey JDBSZVDIUIRSDG-DAFODLJHSA-N
Search UniChem for chemicals with the same backbone JDBSZVDIUIRSDG

Product suppliers

Tocris
LM 10
Cat. No. 5794