UCSF

ZINC06046362

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2006 14 Yes

Popular Name: 2-Chloro-N,N-diethylnicotinamide 2-Chloro-N,N-diethylnicotinamide

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CAS Numbers: 38029-99-1 , [38029-99-1]

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) 1.39 5.07 -12.04 0 3 0 33 212.68 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 21? Alfa-Aesar
Melting_Point 21° Alfa-Aesar
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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