UCSF

ZINC04312848

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2005 11 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) -0.82 0.17 -103.8 5 3 2 52 160.261 3

Vendor Notes

Note Type Comments Provided By
BP 79-80°/0.07 Torr Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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