UCSF

ZINC31283519

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) 6.37 12.41 -142.44 4 4 2 52 414.634 15
Hi High (pH 8-9.5) 6.37 10.18 -5.63 2 4 0 43 412.618 15
Mid Mid (pH 6-8) 6.37 11.34 -48.89 3 4 1 47 413.626 15

Activity (Go SEA)

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