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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 191 192 193 194 195 196 197 198 199 200  Next >> [205]
Species: 4932
Condition: SWR1
Replicates: 2
Raw OD Value: r im 0.6656±0.00452548
Normalized OD Score: sc h 1.0171±0.00479916
Z-Score: 0.6981±0.189248
p-Value: 0.488994
Z-Factor: -7.11715
Fitness Defect: 0.7154
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:24|D11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.40 Celcius
Date:2008-01-31 YYYY-MM-DD
Plate CH Control (+):0.040725±0.00064
Plate DMSO Control (-):0.6174±0.03005
Plate Z-Factor:0.8335
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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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