UCSF

ZINC00158805

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) 1.57 3.94 -5.88 0 2 0 18 189.056 0

Vendor Notes

Note Type Comments Provided By
Boiling_Point 101-102?/15mm Alfa-Aesar
Boiling_Point 101-102°/15mm Alfa-Aesar
MP 30-34 °C(lit.) Indofine
MP 32-32o C Indofine
MP 32-34° Oakwood Chemical
Melting_Point 32-37? Alfa-Aesar
Melting_Point 32-37° Alfa-Aesar
BP 95-97°/2mm Oakwood Chemical
Purity 97% Fluorochem
melting_point BP: (15mm Hg) 99 KeyOrganics
Warnings IRRITANT Matrix Scientific
SOLUBILITY Soluble in Chloroform Indofine

Activity (Go SEA)

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

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