UCSF

ZINC40442627

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 11 Yes

Popular Name: 3-Bromo-1-methyl-1H-pyrrolo[2,3-b]pyridine 3-Bromo-1-methyl-1H-pyrrolo[2,3-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 281192-91-4 , [119031-08-2] , [119032-26-7] , [281192-91-4]

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) 2.06 6.05 -6.64 0 2 0 18 211.062 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

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Rings

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

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