SUCCINOBUCOL

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: J1J54V24R4

Structure
InChI Key RKSMVPNZHBRNNS-UHFFFAOYSA-N
Smile CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1cc(C(C)(C)C)c(OC(=O)CCC(=O)O)c(C(C)(C)C)c1
InChI
InChI=1S/C35H52O5S2/c1-31(2,3)23-17-21(18-24(29(23)39)32(4,5)6)41-35(13,14)42-22-19-25(33(7,8)9)30(26(20-22)34(10,11)12)40-28(38)16-15-27(36)37/h17-20,39H,15-16H2,1-14H3,(H,36,37)

Physicochemical Descriptors

Property Name Value
Molecular Formula C35H52O5S2
Molecular Weight 616.93
AlogP 9.97
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 83.83
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 42.0

Pharmacology

Action Mechanism of Action Reference
None Antioxidant, anti-inflammatory, antiplatelet PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Adhesion
- 6000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Diabetes Mellitus 2 D003920 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL83626
DrugBank DB05399
EPA CompTox DTXSID10176003
FDA SRS J1J54V24R4
PubChem 216325
SureChEMBL SCHEMBL347492
ZINC ZINC000003937467
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