UCSF

ZINC53993884

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) -0.02 2.11 -44.33 0 4 -1 53 172.204 4

Vendor Notes

Note Type Comments Provided By
MP 131-133° Matrix Scientific
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0765160A1; US6096740; WO1995020958A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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