UCSF

ZINC44135171

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 12 No

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) 0.66 3.97 -5.55 0 3 0 43 184.113 5

Vendor Notes

Note Type Comments Provided By
Melting_Point 30? Alfa-Aesar
Melting_Point 30° Alfa-Aesar
Boiling_Point 129-130? Alfa-Aesar
Boiling_Point 129-130° Alfa-Aesar

Activity (Go SEA)

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