Home | Screening data | Screen comparisons | Search for compounds | Structure search

Compound InformationSONAR Target prediction
Name:

gamma-AMINOBUTYRIC ACID

Unique Identifier:SPE01500678
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C4H9NO2
Molecular Weight:94.0483 g/mol
X log p:-1.394  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:3
Canonical Smiles:NCCCC(O)=O
Source:widely distributed in higher plants
Therapeutics:antihypertensive
Generic_name:GAMMA(AMINO)-BUTYRIC ACID
Chemical_iupac_name:GAMMA-AMINO-BUTANOIC ACID
Drug_type:Experimental
Drugbank_id:EXPT00402
Logp:-0.55
Drug_category:L-Arginine: Glycine Amidinotransferase inhibitor
Organisms_affected:-1

Found: 114 nonactive as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70  Next >> [114]
Species: 4932
Condition: MCK1
Replicates: 2
Raw OD Value: r im 0.6102±0.0000707107
Normalized OD Score: sc h 1.0279±0.00790958
Z-Score: 1.2011±0.429709
p-Value: 0.250944
Z-Factor: -6.22938
Fitness Defect: 1.3825
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:19|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.60 Celcius
Date:2007-11-13 YYYY-MM-DD
Plate CH Control (+):0.038825±0.00202
Plate DMSO Control (-):0.578825±0.11216
Plate Z-Factor:0.3232
png
ps
pdf

DBLink | Rows returned: 20<< Back 1 2 3 4 Next >> 
4069074 (3-carboxy-2,2-dimethyl-propyl)azanium
4189826 3-carboxybutylazanium
5460232 4-aminobutanoate
6604938 (3R)-4-amino-3-methyl-butanoic acid
6954859 (2S)-4-azaniumyl-2-methyl-butanoate
6954860 (2R)-4-azaniumyl-2-methyl-butanoate

internal high similarity DBLink | Rows returned: 1
LOPAC 00598 1.0000

active | Cluster 13075 | Additional Members: 7 | Rows returned: 1
SPE01500114 0

Service provided by the Mike Tyers Laboratory