UCSF

ZINC19483361

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 19 Yes

Popular Name: 1-[3-(acetylamino)phenyl]-5-oxopyrrolidine-3-carboxylic acid 1-[3-(acetylamino)phenyl]-5-oxop…

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CAS Numbers: , 1016874-64-8

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) -0.16 4.11 -48.88 1 6 -1 90 261.257 3 ↓
Lo Low (pH 4.5-6) -0.16 2.98 -20.74 2 6 0 87 262.265 3 ↓

Vendor Notes

Note Type Comments Provided By
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.