UCSF

ZINC33754466

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) -0.72 3.45 -98.24 5 4 2 62 250.342 1
Mid Mid (pH 6-8) -0.72 1.17 -43.27 4 4 1 60 249.334 1
Mid Mid (pH 6-8) -0.72 3.05 -40.12 4 4 1 60 249.334 1

Activity (Go SEA)

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