UCSF

ZINC02386473

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 16 Yes

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) 2.88 2.78 -51.13 0 4 -1 59 235.137 4

Vendor Notes

Note Type Comments Provided By
mp 63 - 65 MolMall (formerly Molecular Diversity Preservation International)
MP 63-65° Oakwood Chemical
Melting_Point 63-68? Alfa-Aesar
Melting_Point 63-68° Alfa-Aesar
Purity 97% Fluorochem

Activity (Go SEA)

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