UCSF

ZINC04116666

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) 4.81 11.69 -42.46 1 2 1 17 315.506 5
Lo Low (pH 4.5-6) 4.81 12.07 -74.25 2 2 2 19 316.514 5

Activity (Go SEA)

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