UCSF

ZINC19255804

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 13 Yes

Popular Name: 1-(2-Diethylaminoethyl)-piperazine 1-(2-Diethylaminoethyl)-piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1185301-21-6 , 4038-92-0 , [1185301-21-6]

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) 0.42 3.33 -85.45 3 3 2 24 187.331 5 ↓
Hi High (pH 8-9.5) 0.42 1.3 -38.76 2 3 1 23 186.323 5 ↓
Hi High (pH 8-9.5) 0.42 1.98 -31.46 2 3 1 20 186.323 5 ↓
Mid Mid (pH 6-8) 0.42 0.85 -20.22 1 3 0 22 185.315 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 84-86°C/0.2mm Fluorochem
Purity 98% Fluorochem
BP 99°/5mm Oakwood Chemical
Warnings IRRITANT Matrix Scientific

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