UCSF

ZINC05761883

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 12 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) 4.33 2.7 -5.23 0 1 0 17 168.28 8

Vendor Notes

Note Type Comments Provided By
Melting_Point 261-263? Alfa-Aesar
Melting_Point 261-263° Alfa-Aesar
Boiling_Point 95?/4mm Alfa-Aesar
Boiling_Point 95°/4mm Alfa-Aesar

Activity (Go SEA)

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