UCSF

ZINC22042132

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) 1.39 5.92 -15.61 1 9 0 89 446.939 6
Mid Mid (pH 6-8) 1.39 8.18 -49.14 2 9 1 90 447.947 6
Mid Mid (pH 6-8) 1.39 8.24 -52.87 2 9 1 90 447.947 6

Activity (Go SEA)

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