UCSF

ZINC16739302

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 16 Yes

Popular Name: Pyrrolidin-1-yl-p-tolyl-acetic acid Pyrrolidin-1-yl-p-tolyl-acetic acid

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CAS Numbers: 490026-99-8 , [490026-99-8]

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) 2.02 8.13 -31.84 1 3 0 45 219.284 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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