UCSF

ZINC05161652

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) 0.80 -1.26 -5.98 3 3 0 52 151.165 0
Mid Mid (pH 6-8) -0.50 -1.1 -6.55 1 3 0 50 151.165 0
Mid Mid (pH 6-8) -0.50 0.14 -6.55 1 3 0 50 151.165 0
Lo Low (pH 4.5-6) 0.80 -0.68 -40.82 4 3 1 57 152.173 0

Activity (Go SEA)

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