UCSF

ZINC08034721

Substance Information

In ZINC since Heavy atoms Benign functionality
June 28th, 2006 40 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) 9.38 6.77 -12.57 0 0 0 0 552.638 9

Vendor Notes

Note Type Comments Provided By
Melting_Point 317-320? Alfa-Aesar
Melting_Point 317-320° Alfa-Aesar

Activity (Go SEA)

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