UCSF

ZINC01479756

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 13 Yes

Popular Name: 3-(2-Fluorophenoxy)propanoic acid 3-(2-Fluorophenoxy)propanoic acid

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CAS Numbers: 2967-72-8 , 898795-78-3

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) 1.63 4.62 -45.61 0 3 -1 49 183.158 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 112 - 114 Enamine Building Blocks
MP 112...114 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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