UCSF

ZINC31571224

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) 5.32 13.57 -36.54 3 2 1 29 373.564 10
Hi High (pH 8-9.5) 5.32 12.39 -3.58 2 2 0 24 372.556 10
Mid Mid (pH 6-8) 5.32 14.65 -87.54 4 2 2 33 374.572 10

Activity (Go SEA)

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