UCSF

ZINC13408283

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 27 Yes

Popular Name: 2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenoxy-vinyl]-1,3-benzothiazole 2-[(Z)-2-(1,3-benzodioxol-5-yl)-…

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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) 5.72 10.72 -10.94 0 4 0 41 373.433 4 ↓

Vendor Notes

Note Type Comments Provided By
mp 169 - 171 MolMall (formerly Molecular Diversity Preservation International)

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Rings

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

No pre-computed analogs available. Try a structural similarity search.