UCSF

ZINC16123676

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 22nd, 2008 14 Yes

Popular Name: 1-(2-bromobenzyl)piperidine 1-(2-bromobenzyl)piperidine

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CAS Numbers: 1459-22-9 , [1459-22-9]

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) 3.41 8.99 -29.11 1 1 1 4 255.179 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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