UCSF

ZINC13656634

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) 2.17 4.71 -7.79 1 2 0 29 170.574 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 148-150? Alfa-Aesar
Melting_Point 148-150° Alfa-Aesar
Purity 95% Fluorochem
Purity 95+% Fluorochem
PUBCHEM_PATENT_ID EP0994890A2; WO1998056761A2 IBM Patent Data
Warnings Irritant Matrix Scientific
Purity tech Matrix Scientific

Activity (Go SEA)

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

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