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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 71 72 73 74
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.3623±0.00579828
Normalized OD Score: sc h 0.6771±0.00631837
Z-Score: -9.0316±0.18851
p-Value: 3.08468e-19
Z-Factor: 0.542948
Fitness Defect: 42.6227
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:21|G11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.00 Celcius
Date:2008-06-05 YYYY-MM-DD
Plate CH Control (+):0.04055±0.00021
Plate DMSO Control (-):0.5157±0.02128
Plate Z-Factor:0.8318
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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

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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