UCSF

ZINC08729157

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 18 Yes

Popular Name: 1-[4-(Aminocarbonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid 1-[4-(Aminocarbonyl)phenyl]-5-ox…

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CAS Numbers: , 885953-76-4

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 1.99 -47.32 2 6 -1 104 247.23 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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