UCSF

ZINC29469543

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) 4.94 5.68 -48.75 2 7 0 93 423.494 6
Hi High (pH 8-9.5) 4.94 5.28 -50.32 1 7 -1 92 422.486 6
Hi High (pH 8-9.5) 4.94 5.31 -17.55 2 7 0 90 423.494 6

Activity (Go SEA)

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