UCSF

ZINC00169982

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 9 No

Popular Name: 5-Bromothiophene-2-carboxaldehyde oxime 5-Bromothiophene-2-carboxaldehyd…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2160-63-6 , [2160-63-6]

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) 3.19 2.07 -4.83 1 2 0 33 206.064 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 132-134? Alfa-Aesar
Melting_Point 132-134° Alfa-Aesar
PUBCHEM_PATENT_ID EP0186252A2; EP0186252B1; US4767758 IBM Patent Data

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

No pre-computed analogs available. Try a structural similarity search.