UCSF

ZINC26898258

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 15 Yes

Popular Name: 1-Boc-3,3-dimethylpiperazine 1-Boc-3,3-dimethylpiperazine

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CAS Numbers: 1187931-03-8 , 259808-67-8 , [259808-67-8]

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) 1.83 4.59 -44.97 2 4 1 46 215.317 2 ↓
Mid Mid (pH 6-8) 1.83 3.37 -5.54 1 4 0 42 214.309 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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