UCSF

ZINC00142826

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 Yes

Popular Name: N-(o-Tolyl)acetamide N-(o-Tolyl)acetamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 120-66-1 , [120-66-1]

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) 1.56 4.29 -8.81 1 2 0 29 149.193 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 109-112? Alfa-Aesar
Melting_Point 109-112° Alfa-Aesar
MP 110 TCI
Boiling_Point 296? Alfa-Aesar
Boiling_Point 296° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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

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