tifluadom

Ligand id: 1667

Name: tifluadom

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 72.94
Molecular weight 393.13
XLogP 5.36
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide
International Nonproprietary Names
INN number INN
5267 tifluadom
Database Links
BindingDB Ligand 50049805
CAS Registry No. 83386-35-0 (source: Scifinder)
ChEMBL Ligand CHEMBL169703
PubChem CID 115208
Search Google for chemical match using the InChIKey NPGABYHTDVGGJK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NPGABYHTDVGGJK
Search PubMed clinical trials tifluadom
Search PubMed titles tifluadom
Search PubMed titles/abstracts tifluadom
Search UniChem for chemical match using the InChIKey NPGABYHTDVGGJK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NPGABYHTDVGGJK
Wikipedia Tifluadom
Comments
The INN-assigned compound tifluadom is a racemic mixture of two enantiomers. The structure shown here does not specify stereochemistry and represents the mixture.