UCSF

ZINC02559887

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 Yes

Popular Name: 2-Acetylaminoisonicotinic acid 2-Acetylaminoisonicotinic acid

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CAS Numbers: 54221-95-3 , [54221-95-3]

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) 0.12 2.69 -50.53 1 5 -1 82 179.155 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 286-287° Matrix Scientific
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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