UCSF

ZINC25625484

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2009 15 No

Download: MOL2 SDF SMILES Flexibase

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) 3.65 7.87 -8.63 0 3 0 43 212.289 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 76-80? Alfa-Aesar
Melting_Point 76-80° Alfa-Aesar
Boiling_Point 95-96?/0.3mm Alfa-Aesar
Boiling_Point 95-96°/0.3mm Alfa-Aesar

Activity (Go SEA)

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