UCSF

ZINC00057962

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) 0.99 4.68 -11.45 0 2 0 30 164.135 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 114-115? Alfa-Aesar
Melting_Point 114-115° Alfa-Aesar
MP 166 - 168 Enamine Building Blocks
Melting_Point 166-169? Alfa-Aesar
Melting_Point 166-169° Alfa-Aesar
MP 166...168 Enamine Building Blocks
MP 166.5-168.5o C Indofine
M.P. 167-169 C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
SOLUBILITY Soluble in Chloroform Indofine
APPEARANCE White crystalline powder Indofine

Activity (Go SEA)

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

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