UCSF

ZINC21487105

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) 4.68 11.34 -37.76 1 3 1 21 318.444 3
Hi High (pH 8-9.5) 4.68 8.96 -6.58 0 3 0 19 317.436 3
Mid Mid (pH 6-8) 4.68 9.22 -25.38 1 3 1 21 318.444 3

Activity (Go SEA)

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