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Compound InformationSONAR Target prediction
Name:

FLAVOKAWAIN B

Unique Identifier:SPE00201610
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:268.18 g/mol
X log p:19.808  (online calculus)
Lipinksi Failures1
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:5
Canonical Smiles:COc1cc(O)c(C(=O)C=Cc2ccccc2)c(OC)c1
Class:flavone
Source:Piper, Alpinia & Myrica spp
Reference:Z Naturforsch B 18: 370 (1963)

Found: 337 nonactive | as graph: single | with analogs [1] << Back 331 332 333 334 335 336 337 Next >> [337]
Species: 4932
Condition: UBP6
Replicates: 2
Raw OD Value: r im 0.6033±0.00106066
Normalized OD Score: sc h 0.9436±0.010483
Z-Score: -2.2669±0.287067
p-Value: 0.0262732
Z-Factor: -1.26041
Fitness Defect: 3.6392
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|B9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.40 Celcius
Date:2008-01-24 YYYY-MM-DD
Plate CH Control (+):0.042249999999999996±0.00071
Plate DMSO Control (-):0.6043750000000001±0.01817
Plate Z-Factor:0.9095
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DBLink | Rows returned: 132 3 Next >> 
101990 1-(2,4-dimethoxyphenyl)-3-phenyl-prop-2-en-1-one
242589 1-(2-hydroxy-4,6-dimethoxy-phenyl)-3-phenyl-prop-2-en-1-one
2775759 3-anthracen-9-yl-1-(2,4-dimethoxyphenyl)prop-2-en-1-one
2840952 1-(2,4-dimethoxyphenyl)-3-naphthalen-1-yl-prop-2-en-1-one
4575741 3-phenyl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one
5356121 (E)-1-(2-hydroxy-4,6-dimethoxy-phenyl)-3-phenyl-prop-2-en-1-one

internal high similarity DBLink | Rows returned: 0

active | Cluster 9714 | Additional Members: 6 | Rows returned: 4
SPE01505153 0.551724137931034
SPE00201727 0.487179487179487
SPE00201081 0.458333333333333
SPE00200441 0

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