UCSF

ZINC17860395

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2008 16 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 5.01 10.56 -3.61 0 0 0 0 206.288 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 151-154? Alfa-Aesar
Melting_Point 151-154° Alfa-Aesar
Boiling_Point 350?/720mm Alfa-Aesar
Boiling_Point 350°/720mm Alfa-Aesar

Activity (Go SEA)

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