UCSF

ZINC00334860

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Substance Information

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

Popular Name: 3-(3,5-dichlorophenyl)propanoic acid 3-(3,5-dichlorophenyl)propanoic …

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CAS Numbers: 95333-95-2 , [95333-95-2]

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) 3.16 6.74 -42.45 0 2 -1 40 218.059 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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