UCSF

ZINC04202500

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 9 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) 3.48 1.9 -3.05 0 1 0 17 148.633 4

Vendor Notes

Note Type Comments Provided By
Boiling_Point 163? Alfa-Aesar
Boiling_Point 163° Alfa-Aesar

Activity (Go SEA)

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