UCSF

ZINC31561393

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) 5.72 13.83 -38.44 2 1 1 17 328.479 4
Mid Mid (pH 6-8) 5.72 12.9 -3.98 1 1 0 12 327.471 4

Activity (Go SEA)

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