indisulam   Click here for help

GtoPdb Ligand ID: 7046

Synonyms: E7070
PDB Ligand
Compound class: Synthetic organic
Comment: Indisulam is an anticancer sulfonamide that is in clinical development. This compound belongs to the family of carbonic anhydrase inhibitors. It also behaves as a type of molecular glue that targets certain proteins for ubiquitination and proteasomal degradation [1,3], by bringing them into the proximity the CUL4-DDB1-DDA1-DCAF15 E3 ubiquitin ligase complex.
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 138.88
Molecular weight 385
XLogP 1.9
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES Clc1c[nH]c2c1cccc2NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N
Isomeric SMILES Clc1c[nH]c2c1cccc2NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N
InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20)
Classification Click here for help
Compound class Synthetic organic
Ligand families/groups PROTACs, molecular glues and other degraders
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
8199 indisulam
Synonyms Click here for help
Database Links Click here for help
CAS Registry No. 165668-41-7
ChEMBL Ligand CHEMBL77517
GtoPdb PubChem SID 178103625
PubChem CID 216468
Search Google for chemical match using the InChIKey SETFNECMODOHTO-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SETFNECMODOHTO
Search PubMed clinical trials indisulam
Search PubMed titles indisulam
Search PubMed titles/abstracts indisulam
UniChem Compound Search for chemical match using the InChIKey SETFNECMODOHTO-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey SETFNECMODOHTO-UHFFFAOYSA-N

Product suppliers

View disclaimer

Indisulam (links to external site)
Cat. No. 6782