UCSF

ZINC03887687

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 18 Yes

Popular Name: 2-((3-Bromobenzyl)oxy)benzoic acid 2-((3-Bromobenzyl)oxy)benzoic acid

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CAS Numbers: 743453-43-2 , [743453-43-2]

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) 4.32 0.67 -58.59 0 3 -1 49 306.135 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 108 - 110 Enamine Building Blocks
MP 108...110 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% )