UCSF

ZINC14983007

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 14 Yes

Popular Name: Methyl 6-bromo-1H-indazole-4-carboxylate Methyl 6-bromo-1H-indazole-4-car…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 885518-49-0 , [885518-49-0]

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) 2.17 4.26 -5.73 1 4 0 55 255.071 2 ↓
Ref Reference (pH 7) 2.17 4.37 -6.39 1 4 0 55 255.071 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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

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