UCSF

ZINC96170990

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) 5.05 9.97 -31.49 2 3 0 33 300.813 4
Mid Mid (pH 6-8) 5.05 9.87 -8.19 1 3 0 32 299.805 4
Lo Low (pH 4.5-6) 5.05 9.98 -31.18 2 3 0 33 300.813 4
Lo Low (pH 4.5-6) 5.05 10.41 -19.55 3 3 0 34 301.821 4

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.