UCSF

ZINC22052832

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 14 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) 1.27 3.03 -5.4 0 4 0 33 200.282 2
Mid Mid (pH 6-8) 1.27 5.44 -41.44 1 4 1 34 201.29 2

Vendor Notes

Note Type Comments Provided By
BP 67°/0.2mm Oakwood Chemical
Purity 95% Fluorochem

Activity (Go SEA)

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