UCSF

ZINC19943814

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) -0.26 1.16 -3.67 2 3 0 52 149.215 4
Hi High (pH 8-9.5) -0.26 1.67 -37.06 2 3 -1 52 148.207 4

Vendor Notes

Note Type Comments Provided By
MP 123-125 °C(lit.) Indofine
Melting_Point 123-125? Alfa-Aesar
Melting_Point 123-125° Alfa-Aesar
Mp [°C] 125 - 129 Acros Organics
MP 128 TCI
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Purity 98%min APIChem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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