UCSF

ZINC03882684

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 13 Yes

Popular Name: 1-isobutyl-5-oxopyrrolidine-3-carboxylic acid 1-isobutyl-5-oxopyrrolidine-3-ca…

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CAS Numbers: 773865-07-9 , [773865-07-9]

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) 0.53 5.09 -41.34 0 4 -1 60 184.215 3 ↓
Lo Low (pH 4.5-6) 0.53 3.09 -9.67 1 4 0 58 185.223 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 83 - 85 Enamine Building Blocks
MP 83...85 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% )