UCSF

ZINC04523265

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) 0.18 -5.59 -18.32 7 9 0 168 418.398 3
Hi High (pH 8-9.5) 0.18 -4.59 -70.34 6 9 -1 171 417.39 3
Hi High (pH 8-9.5) 0.18 -4.59 -68.92 6 9 -1 171 417.39 3
Hi High (pH 8-9.5) 0.18 -4.59 -73.08 6 9 -1 171 417.39 3
Hi High (pH 8-9.5) 0.18 -4.59 -66.99 6 9 -1 171 417.39 3

Activity (Go SEA)

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