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Compound InformationSONAR Target prediction
Name:

CHRYSIN DIMETHYL ETHER

Unique Identifier:SPE01500739
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17H14O4
Molecular Weight:268.18 g/mol
X log p:17.421  (online calculus)
Lipinksi Failures1
TPSA44.76
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:COc1cc(OC)c2C(=O)C=C(Oc2c1)c1ccccc1
Source:ex Boesenburgia pandurata, Leptosermum scoparium

Found: 38 active | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [38]
Species: 4932
Condition: NBP2
Replicates: 2
Raw OD Value: r im 0.5497±0.0500632
Normalized OD Score: sc h 0.7520±0.06888
Z-Score: -6.0559±0.690503
p-Value: 0.0000000129375
Z-Factor: -0.489651
Fitness Defect: 18.1631
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:24|C7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2006-02-17 YYYY-MM-DD
Plate CH Control (+):0.038325±0.00486
Plate DMSO Control (-):0.691525±0.03422
Plate Z-Factor:0.7953
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DBLink | Rows returned: 2
88881 5,7-dimethoxy-2-phenyl-chromen-4-one
1636405 2-phenyl-5,7-bis(phenylmethoxy)chromen-4-one

internal high similarity DBLink | Rows returned: 19<< Back 1 2 3 4 Next >> 
SPE01400010 0.9247
LOPAC 00653 0.9437
JFD 00149 0.9437
JFD 02380 0.9448
BTB 14494 0.9568
SPE00200499 0.9577

active | Cluster 4262 | Additional Members: 9 | Rows returned: 2
SPE01501197 0.431372549019608
SPE01500738 0.388888888888889

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