UCSF

ZINC26898439

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 18 Yes

Popular Name: methyl 4-amino-1-benzylpiperidine-4-carboxylate methyl 4-amino-1-benzylpiperidin…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 57611-57-1 , [57611-57-1]

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) 1.47 6.05 -43.64 3 4 1 57 249.334 4 ↓
Lo Low (pH 4.5-6) 1.47 6.3 -125.37 4 4 2 58 250.342 4 ↓

Vendor Notes

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

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