UCSF

ZINC00164886

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 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) 1.51 3.1 -30.15 0 4 -1 69 156.092 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 91-93? Alfa-Aesar
Melting_Point 91-93° Alfa-Aesar
MP 93-95° Matrix Scientific
Purity 98% Fluorochem
Purity 99% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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