UCSF

ZINC33754698

Annotations

Vendors

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) 1.76 4.93 -21.55 2 7 0 88 332.335 4
Hi High (pH 8-9.5) 1.76 6.14 -60.43 1 7 -1 90 331.327 4
Lo Low (pH 4.5-6) 1.76 5.03 -40.42 3 7 1 89 333.343 4

Activity (Go SEA)

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

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