UCSF

ZINC36533696

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2009 13 Yes

Popular Name: (2,2-Difluorobenzo[d][1,3]dioxol-5-yl)methanol (2,2-Difluorobenzo[d][1,3]dioxol…

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CAS Numbers: 72768-97-9 , [72768-97-9]

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) 1.79 0.92 -6.79 1 3 0 39 188.129 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Rings

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