UCSF

ZINC01668115

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) 1.36 2.42 -5.72 2 4 0 69 192.005 1

Vendor Notes

Note Type Comments Provided By
MP 200-250°(dec.) Oakwood Chemical
MP 208-224° Oakwood Chemical
MP 300° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 96% Fluorochem
Melting_Point ca 220? Alfa-Aesar
Melting_Point ca 220° Alfa-Aesar
Warnings IRRITANT, KEEP COLD Matrix Scientific
Warnings Irritant/Refrigerate Matrix Scientific

Activity (Go SEA)

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

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