UCSF

ZINC01400160

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) 0.78 0.3 -12.13 2 3 0 56 210.18 2

Vendor Notes

Note Type Comments Provided By
melting_point 159 - 161 KeyOrganics
MP 42 - 45 oC Matrix Scientific
MP 42-45° Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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