UCSF

ZINC03749317

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2004 17 Yes

Popular Name: 1-(2-Fluoro-benzyl)-piperidine-3-carboxylic acid 1-(2-Fluoro-benzyl)-piperidine-3…

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CAS Numbers: 1185299-70-0 , 896046-65-4

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) 1.88 7.53 -53.27 1 3 0 45 237.274 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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