UCSF

ZINC08217326

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) -5.41 -18.56 -169.58 16 16 3 280 530.548 6
Hi High (pH 8-9.5) -5.41 -20.04 -64.13 14 16 1 274 528.532 6
Hi High (pH 8-9.5) -5.41 -19.77 -22.01 13 16 0 272 527.524 6
Hi High (pH 8-9.5) -5.41 -19.31 -51.07 14 16 1 277 528.532 6
Mid Mid (pH 6-8) -5.41 -18.95 -122.42 15 16 2 278 529.54 6

Activity (Go SEA)

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