UCSF

ZINC02583497

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 9 No

Popular Name: 3-Aminoisonicotinaldehyde 3-Aminoisonicotinaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1187174-13-5 , 1220039-62-2 , 55279-29-3 , [1187174-13-5] , [55279-29-3]

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) 0.07 0.43 -8.5 2 3 0 56 122.127 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Melting_Point ca 92? Alfa-Aesar
Melting_Point ca 92° Alfa-Aesar
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.