Bafetinib

Basic Information

CAS ID: 859212-16-1
Molecular Formula: C30H31F3N8O
Molecular Weight: 576.6 g/mol
Monoisotopic Mass: 576.2573 g/mol
Class: Small Molecule
Natural Product: No
Other Names: INNO-406 | BAFETINIB | NS-187 | CNS-9
Analysis: Drug repositioning mechanism analysis

N N F F F O NH NH N N N N

Compound Structure and Identifier

InChI: InChI=1S/C30H31F3N8O/c1-19-4-7-23(13-27(19)39-29-36-10-8-26(38-29)22-14-34-18-35-15-22)37-28(42)20-5-6-21(25(12-20)30(31,32)33)16-41-11-9-24(17-41)40(2)3/h4-8,10,12-15,18,24H,9,11,16-17H2,1-3H3,(H,37,42)(H,36,38,39)/t24-/m0/s1 See All
InChI Key: ZGBAJMQHJDFTQJ-DEOSSOPVSA-N
Smiles: CN(C)[C@H]1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc3ccc(C)c(Nc4nccc(n4)c5cncnc5)c3)C1 See All
Molfile: Download

Related Target

Target ID Name Interaction
T0354 Tyrosine-protein kinase Lyn inhibitor

Related Fibrosis Property

Reference Record 1

PubMed ID 27630579 Target ID T0354
Uniprot ID Tyrosine-protein kinase Lyn Name Tyrosine-protein kinase Lyn
Model vitro,mice Fibrosis Disease Pancreatic fibrosis
Process I
Process II cells proliferation,cells migration
Process III prevenet collagen deposition
Mechanism

Related Link

PubChem: 11387605
ChEMBL: CHEMBL206834