UCSF

ZINC03865034

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 20 Yes

Popular Name: 1-(4-Methoxy-benzenesulfonyl)-piperidine-2-carboxylic acid 1-(4-Methoxy-benzenesulfonyl)-pi…

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CAS Number: 253195-12-9

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) -0.01 4.68 -53 0 6 -1 87 298.34 4 ↓

Vendor Notes

Note Type Comments Provided By
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% )