UCSF

ZINC49584834

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 11 Yes

Popular Name: 4-Ethyl-4-piperidinecarboxylic acid hydrochloride 4-Ethyl-4-piperidinecarboxylic a…

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CAS Numbers: 1227465-48-6 , 1269053-68-0

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) 0.34 3.76 -63.68 2 3 0 57 157.213 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 205 - 207 Enamine Building Blocks
MP 205...207 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.