UCSF

ZINC01672955

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

CAS Numbers: 2051-97-0 , [2051-97-0]

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) 2.52 2.22 -4.44 0 1 0 5 157.216 2

Vendor Notes

Note Type Comments Provided By
MP 15 TCI
BP 245 TCI
Boiling_Point 90?/0.9mm Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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