UCSF

ZINC33823896

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) 3.66 9.85 -40.82 1 4 1 34 333.496 7
Hi High (pH 8-9.5) 3.66 7.4 -4.91 0 4 0 33 332.488 7
Lo Low (pH 4.5-6) 3.66 12 -120.9 2 4 2 35 334.504 7

Activity (Go SEA)

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