UCSF

ZINC33754489

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) 3.75 6.19 -5.28 1 3 0 27 374.937 3
Mid Mid (pH 6-8) 3.75 8.54 -37.25 2 3 1 28 375.945 3
Mid Mid (pH 6-8) 3.75 7.61 -36.49 2 3 1 28 375.945 3

Activity (Go SEA)

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