UCSF

ZINC19230025

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 16 Yes

Popular Name: 1-(4-ethoxybenzyl)piperazine 1-(4-ethoxybenzyl)piperazine

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CAS Numbers: 1609395-42-7 , 21867-70-9 , 435345-38-3

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) 1.47 3.67 -41.64 2 3 1 29 221.324 4 ↓
Hi High (pH 8-9.5) 1.47 2.26 -3.76 1 3 0 24 220.316 4 ↓

Vendor Notes

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

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