UCSF

ZINC08217334

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 -19.69 -173.88 16 16 3 280 530.548 6
Hi High (pH 8-9.5) -5.41 -20.41 -49.78 14 16 1 277 528.532 6
Hi High (pH 8-9.5) -5.41 -20.83 -21.33 13 16 0 272 527.524 6
Hi High (pH 8-9.5) -5.41 -20 -59.61 14 16 1 274 528.532 6
Mid Mid (pH 6-8) -5.41 -20.08 -120.23 15 16 2 278 529.54 6

Activity (Go SEA)

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