UCSF

ZINC03747840

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Substance Information

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

Popular Name: 1-(4-Methoxy-benzyl)-pyrrolidine-2-carboxylic acid 1-(4-Methoxy-benzyl)-pyrrolidine…

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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) -0.02 6.25 -42.14 1 4 0 54 235.283 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000033788A2 IBM Patent Data

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