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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] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [101]
Species: 4932
Condition: MET16
Replicates: 2
Raw OD Value: r im 0.6678±0.00148492
Normalized OD Score: sc h 1.0052±0.00807917
Z-Score: 0.2605±0.405505
p-Value: 0.781644
Z-Factor: -7.90221
Fitness Defect: 0.2464
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:21|B10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2007-10-18 YYYY-MM-DD
Plate CH Control (+):0.040375±0.00063
Plate DMSO Control (-):0.64435±0.15745
Plate Z-Factor:0.1364
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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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