UCSF

ZINC00142321

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) -0.51 5.2 -96.96 2 8 -2 138 312.322 8
Mid Mid (pH 6-8) -0.51 3.23 -49.57 3 8 -1 136 313.33 8
Lo Low (pH 4.5-6) -0.51 1.25 -13.89 4 8 0 133 314.338 8

Activity (Go SEA)

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