UCSF

ZINC00391885

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) 1.55 6.12 -13.23 0 4 0 53 194.186 4

Vendor Notes

Note Type Comments Provided By
MP 1 - 2 Enamine Building Blocks
BP [°C] 282 Acros Organics
Boiling_Point 283-284? Alfa-Aesar
Boiling_Point 283-284° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks
Melting_Point ca 5? Alfa-Aesar
Melting_Point ca 5° Alfa-Aesar
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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

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