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Compound InformationSONAR Target prediction
Name:

CHRYSIN

Unique Identifier:SPE01500709
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:244.158 g/mol
X log p:16.715  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Oc1cc(O)c2C(=O)C=C(Oc2c1)c1ccccc1
Class:flavone
Source:Pinus, Scutellaria, and Ulnus spp
Therapeutics:diuretic

Found: 74 active | as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [74]
Species: 4932
Condition: SPE01800170
Replicates: 2
Raw OD Value: r im 0.2813±0.156766
Normalized OD Score: sc h 0.6080±0.339219
Z-Score: -10.4345±8.57641
p-Value: 0.00000621104
Z-Factor: -3.41409
Fitness Defect: 11.9892
Bioactivity Statement: Outlier
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:2|B4
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:20.90 Celcius
Date:2006-12-12 YYYY-MM-DD
Plate CH Control (+):0.039999999999999994±0.00166
Plate DMSO Control (-):0.473±0.07151
Plate Z-Factor:0.7020
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DBLink | Rows returned: 1
5281607 5,7-dihydroxy-2-phenyl-chromen-4-one

internal high similarity DBLink | Rows returned: 27<< Back 1 2 3 4 5 Next >> 
LOPAC 01016 0.9306
SPE01504115 0.9306
JFD 02380 0.9371
RJC 01511 0.9403
JFD 02797 0.9437
SPE00300384 0.9437

active | Cluster 1884 | Additional Members: 20 | Rows returned: 5
SPE01500724 0.345454545454545
SPE01504115 0.294117647058823
SPE00200499 0.24
SPE01505144 0.191489361702128
Prest122 0.1875

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