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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 111 112 113 114 115 116 117 118 119 120  Next >> [205]
Species: 4932
Condition: NPR1
Replicates: 2
Raw OD Value: r im 0.9193±0.0108187
Normalized OD Score: sc h 0.8934±0.0266314
Z-Score: -1.9462±0.418785
p-Value: 0.0619282
Z-Factor: -0.951084
Fitness Defect: 2.7818
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:21|B11
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0012000000000000001±0.00137
Plate DMSO Control (-):1.00785±0.03797
Plate Z-Factor:0.8705
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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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