UCSF

ZINC05511144

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 15 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) 0.77 2.78 -10.02 2 5 0 70 205.217 2
Lo Low (pH 4.5-6) 0.77 -1.24 -33.33 3 5 1 72 206.225 2
Lo Low (pH 4.5-6) 0.77 3.09 -32.73 3 5 1 72 206.225 2

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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