UCSF

ZINC49538628

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 52 No

Other Names:

LS-187549

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.62 4.07 -129.27 7 16 -2 284 716.604 14

Vendor Notes

Note Type Comments Provided By
biological_use Antioxidant IBScreen Bioactives IBScreen Bioactives
mechanism Apoptosis inhibitor IBScreen Bioactives IBScreen Bioactives
Target Caspase-3(P42574)&Myc proto-oncogene protein(P01106)&Retinoblastoma-associated protein(P06400)&Cyclin-dependent kinase inhibitor 2A, isoforms 1/2/3(P42771)&NTF2-related export protein 1(Q9UKK6)&Cellular tumor antigen p53(P04637)&Apoptosis regulator Bcl-2( Herbal Ingredients Targets
mechanism Improve the energy metabolism IBScreen Bioactives
mechanism Reduce lipid peroxides IBScreen Bioactives
mechanism Scavenge free radicals IBScreen Bioactives
biological_use Used for treatment of cerebrovascular disorders IBScreen Bioactives

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.