UCSF

ZINC04217523

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) 1.86 4.98 -11.94 1 6 0 88 255.28 3
Mid Mid (pH 6-8) 1.93 2.76 -36.84 0 6 -1 94 254.272 3

Vendor Notes

Note Type Comments Provided By
mechanism Antimycotic agent ZereneX Building Blocks
biological_use Antiprotozoal ZereneX Building Blocks
biological_use Active against Candida albicans IBScreen Bioactives
mechanism Antimycotic agent IBScreen Bioactives
biological_use Antiprotozoal IBScreen Bioactives IBScreen Bioactives
melting_point Solid KeyOrganics
biological_use Trichomonacide IBScreen Bioactives

Activity (Go SEA)

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

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