UCSF

ZINC03308499

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 15 Yes

Popular Name: 3-Bromo-4-ethoxy-5-methoxybenzoic acid 3-Bromo-4-ethoxy-5-methoxybenzoi…

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CAS Numbers: , 671790-48-0

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) 2.81 0.56 -44.6 0 4 -1 58 274.09 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 140 - 142 Enamine Building Blocks
MP 140...142 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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