UCSF

ZINC22043027

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) 3.10 5.75 -6.29 1 3 0 27 340.492 3
Mid Mid (pH 6-8) 3.10 7.17 -37.5 2 3 1 28 341.5 3
Mid Mid (pH 6-8) 3.10 8.02 -38.1 2 3 1 28 341.5 3

Activity (Go SEA)

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