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Compound InformationSONAR Target prediction
Name:

1-AMINOCYCLOBUTANE CARBOXYLIC ACID

Unique Identifier:SPE01502131
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C5H9NO2
Molecular Weight:106.059 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(CCC1)C(O)=O
Source:(ACBC)
Reference:Eur J Pharmacol 161: 281 (1989)
Therapeutics:NMDA receptor antagonist
Generic_name:2-METHYLLEUCINE
Chemical_iupac_name:2-METHYLLEUCINE
Drug_type:Experimental
Drugbank_id:EXPT00130
Drug_category:Branched-Chain Amino Acid Aminotransferase inhibitor
Organisms_affected:-1

Found: 4 active | as graph: single | with analogs 1 2 3 4 Next >> 
Species: 4932
Condition: CDC73
Replicates: 2
Raw OD Value: r im 0.3075±0.0309006
Normalized OD Score: sc h 0.7322±0.024059
Z-Score: -6.7387±0.252344
p-Value: 0.000000000029159
Z-Factor: -0.311325
Fitness Defect: 24.2583
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:23|F9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2007-09-19 YYYY-MM-DD
Plate CH Control (+):0.0399±0.00093
Plate DMSO Control (-):0.413125±0.03504
Plate Z-Factor:0.6734
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DBLink | Rows returned: 87<< Back 1 2 3 4 5 6 7 8 9 10  Next >> 
176425 (2R)-2-amino-4-methyl-pentanoic acid
194032 (2S)-2-amino-4,4-dimethyl-pentanoic acid
229526 2-amino-2-methyl-pentanoic acid
236508 2-amino-2-cyclopropyl-propanoic acid
272725 2-amino-3,4-dimethyl-pentanoic acid
314104 2-amino-3,4,4-trimethyl-pentanoic acid

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 4858 | Additional Members: 8 | Rows returned: 6
LOPAC 00333 0.368421052631579
SPE01502128 0.294117647058823
LAT003D03 0
LAT003A06 0
SPE01502130 0
LOPAC 00644 0

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