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Compound InformationSONAR Target prediction
Name:

METHOXYVONE

Unique Identifier:SPE01400666
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:252.18 g/mol
X log p:17.063  (online calculus)
Lipinksi Failures1
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:2
Canonical Smiles:COc1cc(C)c2C(=O)C=C(Oc2c1)c1ccccc1
Source:synthetic
Therapeutics:anabolic

Found: 174 nonactive | as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [174]
Species: 4932
Condition: BNI1
Replicates: 2
Raw OD Value: r im 0.6506±0.00339411
Normalized OD Score: sc h 0.9440±0.000429734
Z-Score: -2.7674±0.10834
p-Value: 0.00579162
Z-Factor: -13.7115
Fitness Defect: 5.1513
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|G8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.40 Celcius
Date:2007-09-14 YYYY-MM-DD
Plate CH Control (+):0.04175±0.00027
Plate DMSO Control (-):0.6775249999999999±0.10000
Plate Z-Factor:0.4741
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DBLink | Rows returned: 1
4119 7-methoxy-5-methyl-2-phenyl-chromen-4-one

internal high similarity DBLink | Rows returned: 1
BTB 13710 0.9122

active | Cluster 11689 | Additional Members: 8 | Rows returned: 2
SPE01400010 0.333333333333333
SPE01600652 0.204545454545455

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