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Compound InformationSONAR Target prediction
Name:

CREATININE

Unique Identifier:SPE01600300
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:106.062 g/mol
X log p:-0.031  (online calculus)
Lipinksi Failures0
TPSA20.31
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:CN1CC(=O)NC1=N
Class:alkaloid
Source:metabolite in muscle and urine; renal metabolite
Reference:J Biol Chem 81:73 (1929); JACS 93:5552 (1971)
Therapeutics:metabolic enhancer

Found: 205 nonactive as graph: single | with analogs [1] << Back 161 162 163 164 165 166 167 168 169 170  Next >> [205]
Species: 4932
Condition: POM152
Replicates: 2
Raw OD Value: r im 0.7095±0.00417193
Normalized OD Score: sc h 1.0093±0.00645444
Z-Score: 0.4852±0.338564
p-Value: 0.637274
Z-Factor: -8.6542
Fitness Defect: 0.4506
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:24|D11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.90 Celcius
Date:2008-03-15 YYYY-MM-DD
Plate CH Control (+):0.04045±0.00037
Plate DMSO Control (-):0.676275±0.01600
Plate Z-Factor:0.9160
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 1453 | Additional Members: 1 | Rows returned: 0
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