UCSF

ZINC33868653

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) 2.21 6.12 -47.74 2 5 1 62 433.619 5
Mid Mid (pH 6-8) 2.21 5.31 -45.79 2 5 1 62 433.619 5
Mid Mid (pH 6-8) 2.21 3.86 -14.25 1 5 0 61 432.611 5

Activity (Go SEA)

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