UCSF

ZINC35904598

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2009 13 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) 1.12 2.72 -56.34 4 5 0 96 177.163 1
Mid Mid (pH 6-8) 1.12 2.59 -57.62 3 5 -1 95 176.155 1
Mid Mid (pH 6-8) 1.12 2.66 -47.77 3 5 -1 95 176.155 1

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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