UCSF

ZINC14768538

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) -1.61 -4.32 -56.53 7 11 -1 205 459.431 2
Hi High (pH 8-9.5) -1.61 -3.33 -109.11 6 11 -2 208 458.423 2
Mid Mid (pH 6-8) -2.34 -4.22 -51.59 9 11 1 203 461.447 1
Mid Mid (pH 6-8) -2.92 -3.4 -64.83 8 11 1 200 461.447 1
Mid Mid (pH 6-8) -1.61 -2.38 -48.25 8 11 0 206 460.439 2

Activity (Go SEA)

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