UCSF

ZINC04710158

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 13 Yes

Popular Name: N-[1-(3-Aminophenyl)ethyl]acetamide compound with sulfuric acid (2:1) N-[1-(3-Aminophenyl)ethyl]acetam…

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CAS Numbers: , 103394-66-7

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) 0.47 2.21 -8.32 3 3 0 55 178.235 2 ↓

Vendor Notes

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

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