UCSF

ZINC33839179

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) 2.68 5.87 -47.3 2 4 1 55 262.329 3
Hi High (pH 8-9.5) 2.68 6.63 -37.28 1 4 0 58 261.321 3
Hi High (pH 8-9.5) 2.68 3.69 -9.24 1 4 0 54 261.321 3

Activity (Go SEA)

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