UCSF

ZINC19268506

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 15 Yes

Popular Name: 1-(3-Methoxybenzyl)piperazine 1-(3-Methoxybenzyl)piperazine

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CAS Numbers: 1158445-27-2 , 55212-32-3 , [55212-32-3]

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) 1.07 2.92 -38.95 2 3 1 29 207.297 3 ↓
Hi High (pH 8-9.5) 1.07 1.56 -4.08 1 3 0 24 206.289 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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