UCSF

ZINC01653227

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 Yes

Popular Name: 2-Amino-3-(3,4-dichlorophenyl)propanoic acid 2-Amino-3-(3,4-dichlorophenyl)pr…

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CAS Numbers: 52794-98-6 , 52794-99-7 , 5472-67-3 , 59331-63-4 , [5472-67-3]

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) 0.05 4.09 -39.18 3 3 0 68 234.082 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity >99% Fluorochem
Warnings IRRITANT Matrix Scientific

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