UCSF

ZINC00335953

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 13 Yes

Popular Name: 3-(3-chlorophenoxy)propanoic acid 3-(3-chlorophenoxy)propanoic acid

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CAS Numbers: 7170-50-5 , [7170-50-5]

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) 2.17 0.45 -44.27 0 3 -1 49 199.613 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 85 - 87 Enamine Building Blocks
MP 85...87 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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