UCSF

ZINC19802281

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) 3.87 10.73 -42.61 1 2 1 8 329.464 1
Mid Mid (pH 6-8) 3.87 8.26 -3.93 0 2 0 6 328.456 1
Mid Mid (pH 6-8) 3.87 9.85 -40.77 1 2 1 8 329.464 1

Activity (Go SEA)

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