UCSF

ZINC00011113

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 12 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.44 2.95 -91.3 3 3 2 34 165.24 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 120-122?/2mm Alfa-Aesar
Boiling_Point 120-122°/2mm Alfa-Aesar
BP 92-94°C/0.1mm Fluorochem
Purity 98% Fluorochem

Activity (Go SEA)

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