UCSF

ZINC05903094

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 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) 3.48 7.84 -5.2 0 2 0 26 208.301 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 104-106?/4.5mm Alfa-Aesar
Boiling_Point 104-106°/4.5mm Alfa-Aesar
Melting_Point <-35? Alfa-Aesar
Melting_Point <-35° Alfa-Aesar

Activity (Go SEA)

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