UCSF

ZINC38271946

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2010 16 Yes

Popular Name: 5-(4-fluorophenyl)-1,3-benzodioxole 5-(4-fluorophenyl)-1,3-benzodioxole

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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) 3.79 6.63 -6.57 0 2 0 18 216.211 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0794942A1; EP0794942B1 IBM Patent Data

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