UCSF

ZINC21953399

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) -0.78 -2.22 -34.89 3 4 1 40 186.279 1
Mid Mid (pH 6-8) -0.78 -0.78 -88.97 4 4 2 45 187.287 1
Mid Mid (pH 6-8) -0.78 -3.27 -44.5 3 4 1 43 186.279 1

Activity (Go SEA)

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