UCSF

ZINC00164913

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 13 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) 1.52 3.83 -97.48 0 6 -2 109 181.103 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 232-236? Alfa-Aesar
Melting_Point 232-236° Alfa-Aesar

Activity (Go SEA)

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