lmmol · Compounds

Defactinib

InChIKey FWLMVFUGMHIOAA-UHFFFAOYSA-N Formula C20H21F3N8O3S PubChem CID 25117126 ChEMBL CHEMBL3137331

SMILES CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(NCc3nccnc3N(C)S(C)(=O)=O)n2)cc1

Structure

NNNNNOFFFNNSOON

2D skeletal formula · rendered by chemkit from PubChem 2D coordinates.

Pseudo-3D ball-and-stick · chemkit, from PubChem 3D conformer coordinates.

Protein targets · 2 targets

Each resolved target links to its lmmol protein document; action and mechanism are from the bioactivity record.

A document in the lmmol reference corpus — a real compound (PubChem / ChEMBL identity, chemkit-rendered structure) cross-linked to the protein documents it targets. Hover any link to preview its target.