UCSF

ZINC02389411

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 16 Yes

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) 3.97 3.11 -6.15 0 2 0 26 220.312 8

Vendor Notes

Note Type Comments Provided By
Boiling_Point ca 155?/1.5mm Alfa-Aesar
Boiling_Point ca 155°/1.5mm Alfa-Aesar

Activity (Go SEA)

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