UCSF

ZINC33823849

Annotations

Vendors

    None

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) -5.51 -13.36 -296.66 17 12 4 239 411.5 7
Hi High (pH 8-9.5) -5.51 -14.05 -100.5 15 12 2 236 409.484 7
Mid Mid (pH 6-8) -5.51 -13.76 -191.39 16 12 3 237 410.492 7

Activity (Go SEA)

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