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Compound InformationSONAR Target prediction
Name:

CYCLOPIAZONIC ACID

Unique Identifier:SPE01503912
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C20H20N2O3
Molecular Weight:316.226 g/mol
X log p:7.932  (online calculus)
Lipinksi Failures1
TPSA37.38
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:CC(=O)C1=C(O)C2C3C(Cc4cccc5ncc3c45)C(C)(C)N2C1=O
Therapeutics:inhibits endoplamic reticulum Ca ATPase

Found: 101 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [101]
Species: 4932
Condition: APC9
Replicates: 2
Raw OD Value: r im 0.7024±0.0100409
Normalized OD Score: sc h 1.0105±0.00402972
Z-Score: 0.5680±0.210355
p-Value: 0.574278
Z-Factor: -7.96787
Fitness Defect: 0.5546
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:21|B10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2007-11-22 YYYY-MM-DD
Plate CH Control (+):0.04235±0.00058
Plate DMSO Control (-):0.6687±0.13766
Plate Z-Factor:0.2940
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 4333 | Additional Members: 2 | Rows returned: 0
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