UCSF

ZINC00041053

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 16 Yes

Popular Name: 1-Benzylpiperidine-2-carboxylic acid 1-Benzylpiperidine-2-carboxylic …

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CAS Numbers: 210533-45-2 , 21319-53-9 , 66120-28-3 , [21319-53-9]

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) 0.43 7.51 -39.3 1 3 0 45 219.284 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 134 - 136 Enamine Building Blocks
MP 134...136 Enamine Building Blocks
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% )