UCSF

ZINC33824786

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) 2.02 8.56 -35.14 3 6 1 75 353.483 13
Hi High (pH 8-9.5) 2.02 6.39 -8.95 2 6 0 74 352.475 13
Mid Mid (pH 6-8) 2.02 8.88 -90.54 4 6 2 77 354.491 13

Activity (Go SEA)

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