UCSF

ZINC20397630

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 19 Yes

Popular Name: 1-Boc-4-(piperidin-4-yl)-piperazine 1-Boc-4-(piperidin-4-yl)-piperazine

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CAS Numbers: 205059-24-1 , [205059-24-1]

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) 1.09 3.68 -45.44 2 5 1 49 270.397 3 ↓
Mid Mid (pH 6-8) 1.09 4.47 -42.15 2 5 1 46 270.397 3 ↓
Mid Mid (pH 6-8) 1.09 2.25 -5.14 1 5 0 45 269.389 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 70-74° Oakwood Chemical
Purity 95% Fluorochem
Purity 98% Fluorochem

Activity (Go SEA)

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