UCSF

ZINC01608920

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) 3.82 7.41 -4.67 0 2 0 26 170.252 7

Vendor Notes

Note Type Comments Provided By
Melting_Point 57? Alfa-Aesar
Melting_Point 57° Alfa-Aesar
Boiling_Point 204? Alfa-Aesar
Boiling_Point 204° Alfa-Aesar
BP 88 / 17 TCI
PUBCHEM_PATENT_ID EP0802194A2; EP0802194A3; US5795497 IBM Patent Data

Activity (Go SEA)

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