UCSF

ZINC00164412

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 11 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) 1.77 4.27 -39.19 0 4 -1 69 156.092 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 260? Alfa-Aesar
Boiling_Point 260° Alfa-Aesar
Melting_Point 30-36? Alfa-Aesar
Melting_Point 30-36° Alfa-Aesar
MP 35-37° Matrix Scientific
Purity 97% Matrix Scientific
Purity 99% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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