UCSF

ZINC02567977

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 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) 5.91 10.05 -2.11 2 1 0 26 233.399 9

Vendor Notes

Note Type Comments Provided By
Boiling_Point 218-220?/14mm Alfa-Aesar
Boiling_Point 218-220°/14mm Alfa-Aesar
Melting_Point 23-25? Alfa-Aesar
Melting_Point 23-25° Alfa-Aesar

Activity (Go SEA)

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