UCSF

ZINC37857945

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2009 30 No

Popular Name: (2E)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylene]-7-[[butyl(methyl)amino]methyl]-6-hydroxy-benzofu (2E)-2-[(6-bromo-4H-1,3-benzodio…

Find On: PubMed — Wikipedia — Google

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) 4.89 9.7 -43.18 2 6 1 73 475.359 6 ↓
Mid Mid (pH 6-8) 4.89 10.25 -28.41 1 6 0 76 474.351 6 ↓

Activity (Go SEA)

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