UCSF

ZINC85863173

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) 10.51 38.94 -7.42 0 4 0 53 863.365 31

Vendor Notes

Note Type Comments Provided By
biological_use Cardiovascular agent IBScreen Bioactives IBScreen Bioactives
mechanism Electron transport chain regulator IBScreen Bioactives
biological_use used to treat congestive heart failure IBScreen Bioactives

Activity (Go SEA)

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

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