Details of the Drug

General Information of Drug (ID: DM0SOBR)

• Drug Name: AGI-1096
• Synonyms: 4-[2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydroxyphenylsulfanyl)-1-methylethylsulfanyl]phenoxy]butyric acid

Indication

Disease Entry	ICD 11	Status	REF
Transplant rejection	NE84	Discontinued in Phase 1	[1]

• Chemical Identifiers:
  Formula: C35H54O4S2
  Canonical SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)OCCCC(=O)O)C(C)(C)C
  InChI: 1S/C35H54O4S2/c1-31(2,3)24-18-22(19-25(29(24)38)32(4,5)6)40-35(13,14)41-23-20-26(33(7,8)9)30(27(21-23)34(10,11)12)39-17-15-16-28(36)37/h18-21,38H,15-17H2,1-14H3,(H,36,37)
  InChIKey: YHFUPQNXMNMQAK-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 10218732
  CAS Number: 216167-95-2
  UNII: O7T92N1Y8T
  DrugBank ID: DB05840
  TTD ID: D0C7UR

References

• [1] Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800016776)