torin 1

Ligand id: 8004

Name: torin 1

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 69.64
Molecular weight 607.22
XLogP 7.05
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[4-(4-propanoylpiperazin-1-yl)-3-(trifluoromethyl)phenyl]-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one
Synonyms
Torin-1 | Torin1
Database Links
CAS Registry No. 1222998-36-8
ChEMBL Ligand CHEMBL1256459
PubChem CID 49836027
Search Google for chemical match using the InChIKey AKCRNFFTGXBONI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AKCRNFFTGXBONI
Search UniChem for chemical match using the InChIKey AKCRNFFTGXBONI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AKCRNFFTGXBONI
Comments
Torin 1 is a potent inhibitor of mTOR in both mTOR containing protein complexes, mTORC1 and mTORC2. The discovery of torin 1 is described in [1], where it is compound 37.