UCSF

ZINC31559995

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) 3.76 5.87 -29.31 3 4 1 59 309.389 4
Mid Mid (pH 6-8) 3.76 5.85 -46.97 3 4 1 59 309.389 4
Mid Mid (pH 6-8) 3.76 5.5 -8.43 2 4 0 57 308.381 4

Activity (Go SEA)

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