UCSF

ZINC01985777

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 19 Yes

Popular Name: 1-(2,5-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid 1-(2,5-dimethoxyphenyl)-5-oxopyr…

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CAS Numbers: , 63674-60-2

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) 0.69 4.15 -49.93 0 6 -1 79 264.257 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 100 - 102 Enamine Building Blocks
MP 100...102 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.