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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: SPE01503278
Replicates: 2
Raw OD Value: r im 0.2009±0.00657609
Normalized OD Score: sc h 0.5672±0.0127852
Z-Score: -4.8708±0.795755
p-Value: 0.00000826134
Z-Factor: -6.56717
Fitness Defect: 11.7039
Bioactivity Statement: Toxic
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:2|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2007-01-19 YYYY-MM-DD
Plate CH Control (+):0.25897499999999996±0.00631
Plate DMSO Control (-):0.401625±1.75599
Plate Z-Factor:0.2994
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DBLink | Rows returned: 1
5281607 5,7-dihydroxy-2-phenyl-chromen-4-one

internal high similarity DBLink | Rows returned: 272 3 4 5 Next >> 
SPE01600652 0.9041
BTB 13702 0.9065
SPE01504068 0.9116
SPE00240958 0.9137
BTB 10082 0.9137
SPE01400010 0.9167

nonactive | Cluster 1884 | Additional Members: 20 | Rows returned: 122 Next >> 
SPE01500717 0.452830188679245
SPE01500724 0.345454545454545
SPE01504115 0.294117647058823
SPE00200499 0.24
Prest49 0.24
Prest1131 0.191489361702128

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