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Compound InformationSONAR Target prediction
Name:

N-ACETYLPROLINE

Unique Identifier:SPE01500704
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C7H11NO3
Molecular Weight:146.08 g/mol
X log p:-1.206  (online calculus)
Lipinksi Failures0
TPSA37.38
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:2
Canonical Smiles:CC(=O)N1CCCC1C(O)=O
Therapeutics:antirheumatic
Generic_name:N-ACETYLPROLINE
Chemical_iupac_name:1-ACETYL-D-PROLINE
Drug_type:Experimental
Drugbank_id:EXPT02279
Logp:-0.48
Drug_category:Carbapenem Synthase inhibitor
Organisms_affected:-1

Found: 114 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [114]
Species: 4932
Condition: BCK2
Replicates: 2
Raw OD Value: r im 0.7713±0.00742462
Normalized OD Score: sc h 1.0115±0.00422336
Z-Score: 0.4971±0.239845
p-Value: 0.624156
Z-Factor: -4.14669
Fitness Defect: 0.4714
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:21|D7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.60 Celcius
Date:2006-03-29 YYYY-MM-DD
Plate CH Control (+):0.038625±0.00149
Plate DMSO Control (-):0.73465±0.01307
Plate Z-Factor:0.9387
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DBLink | Rows returned: 6
66141 (2S)-1-acetylpyrrolidine-2-carboxylic acid
322640 1-acetylpyrrolidine-2-carboxylic acid
719436 (2R)-1-acetylpyrrolidine-2-carboxylic acid
2810164 1-acetylpyrrolidine-2-carboxylic acid hydrate
6927011 (2R)-1-acetylpyrrolidine-2-carboxylate
6927012 (2S)-1-acetylpyrrolidine-2-carboxylate

internal high similarity DBLink | Rows returned: 2
SEW 04242 0.9818
HTS 01510 1.0000

nonactive | Cluster 1058 | Additional Members: 7 | Rows returned: 3
SPE01500682 0
LOPAC 00579 0
Prest103 0

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