UCSF

ZINC33823854

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) 3.14 7.42 -46.54 1 3 -1 52 220.292 5
Lo Low (pH 4.5-6) 3.14 8.01 -62.33 2 3 0 57 221.3 5

Activity (Go SEA)

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