UCSF

ZINC12359293

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) 1.89 3.04 -42.38 3 1 1 28 160.599 1
Hi High (pH 8-9.5) 2.08 6.17 -48.34 6 7 1 112 407.473 4

Vendor Notes

Note Type Comments Provided By
Purity 95% Matrix Scientific
Purity 97% Fluorochem
Warnings Corrosive/Irritant Matrix Scientific
Warnings IRRITANT, CORROSIVE Matrix Scientific

Activity (Go SEA)

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

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