UCSF

ZINC33754960

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) 2.62 7.83 -8.93 0 4 0 33 322.408 4
Mid Mid (pH 6-8) 2.62 10.11 -42.22 1 4 1 34 323.416 4
Mid Mid (pH 6-8) 2.62 10.11 -42.54 1 4 1 34 323.416 4

Activity (Go SEA)

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