UCSF

ZINC08101191

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) -5.70 -15.78 -414.87 20 14 5 276 472.56 6
Hi High (pH 8-9.5) -5.70 -16.85 -96.93 17 14 2 271 469.536 6
Hi High (pH 8-9.5) -5.70 -16.83 -117.9 17 14 2 271 469.536 6
Mid Mid (pH 6-8) -5.70 -16.11 -271.74 19 14 4 275 471.552 6
Mid Mid (pH 6-8) -5.70 -16.22 -300.68 19 14 4 275 471.552 6

Activity (Go SEA)

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