UCSF

ZINC33825701

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) 2.23 6.85 -36.61 1 3 1 17 247.362 1
Hi High (pH 8-9.5) 2.23 4.48 -3.12 0 3 0 16 246.354 1

Activity (Go SEA)

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