UCSF

ZINC33828187

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) 3.39 6.11 -43.14 3 4 1 48 377.917 1
Hi High (pH 8-9.5) 3.39 3.76 -6.52 2 4 0 47 376.909 1

Activity (Go SEA)

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