UCSF

ZINC33825356

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) 2.25 5.63 -7.92 0 5 0 45 333.457 5
Mid Mid (pH 6-8) 2.25 6.58 -7.67 0 5 0 45 333.457 5
Mid Mid (pH 6-8) 2.25 8.03 -40.62 1 5 1 46 334.465 5
Mid Mid (pH 6-8) 2.25 8.84 -37.93 1 5 1 46 334.465 5

Activity (Go SEA)

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