UCSF

ZINC01847836

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 13 Yes

Popular Name: Piperazine-1-carboxylic acid diethylamide Piperazine-1-carboxylic acid die…

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CAS Numbers: 119-54-0 , 20127-99-5 , [119-54-0] , [20127-99-5]

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) 0.29 3.2 -49.14 2 4 1 40 186.279 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 113.5-115.5/3mm Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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