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Compound InformationSONAR Target prediction
Name:

ACC

Unique Identifier:LAT003D03
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C4H7NO2
Molecular Weight:94.0483 g/mol
X log p:-2.117  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:NC1(CC1)C(O)=O
Generic_name:1-AMINOCYCLOPROPANECARBOXYLIC ACID
Chemical_iupac_name:1-AMINOCYCLOPROPANECARBOXYLIC ACID
Drug_type:Experimental
Drugbank_id:EXPT00065
Drug_category:1-Aminocyclopropane-1-Carboxylate Deaminase inhibitor
Organisms_affected:-1

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr22h
Replicates: 2
Raw OD Value: r im 0.6732±0.00289914
Normalized OD Score: sc h 1.0034±0.0224305
Z-Score: 0.2808±0.766213
p-Value: 0.602414
Z-Factor: -38.7166
Fitness Defect: 0.5068
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:3|D3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040175±0.00260
Plate DMSO Control (-):0.652475±0.01329
Plate Z-Factor:0.9465
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DBLink | Rows returned: 76<< Back 11 12 13 Next >> 
11051625 (2S)-2-amino-3-methyl-butanoic acid
11105566 [(1S)-1-carboxy-2-methyl-propyl]azanium chloride
11147708 lithium (2S)-2-amino-3-methyl-butanoate
11263496 (2S)-2-amino-3-methyl-butanoic acid
11274992 (2S)-2-amino-3-methyl-butanoic acid
11446553 [(1R)-1-carboxy-2,2-dimethyl-propyl]azanium chloride

internal high similarity DBLink | Rows returned: 2
LOPAC 00644 1.0000
SPE01502130 1.0000

active | Cluster 4858 | Additional Members: 8 | Rows returned: 1
SPE01502131 0.2

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