UCSF

ZINC01651942

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 Yes

Popular Name: 3-Bromo-4-hydroxy-5-methoxy-benzoic acid 3-Bromo-4-hydroxy-5-methoxy-benz…

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CAS Numbers: 2973-76-4 , 6324-52-3

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) 2.15 -1.49 -45.15 1 4 -1 70 246.036 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 197 - 199 Enamine Building Blocks
MP 197...199 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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