UCSF

ZINC02166564

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 12 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) 2.72 2.07 -6.66 0 1 0 17 162.232 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 11-13? Alfa-Aesar
Melting_Point 11-13° Alfa-Aesar
Boiling_Point 222? Alfa-Aesar
Boiling_Point 222° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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