UCSF

ZINC19802278

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 10.7 -42.55 1 2 1 8 329.464 1
Mid Mid (pH 6-8) 3.87 8.23 -3.87 0 2 0 6 328.456 1
Mid Mid (pH 6-8) 3.87 9.82 -40.95 1 2 1 8 329.464 1

Activity (Go SEA)

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