UCSF

ZINC31570363

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) 3.69 10.85 -42.17 1 4 1 34 367.513 8
Mid Mid (pH 6-8) 3.69 10.75 -43.95 1 4 1 34 367.513 8
Mid Mid (pH 6-8) 3.69 8.78 -7.87 0 4 0 33 366.505 8

Activity (Go SEA)

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