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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 61 62 63 64 65 66 67 68 69 70  Next >> [74]
Species: 4932
Condition: KEM1
Replicates: 2
Raw OD Value: r im 0.5275±0.0126572
Normalized OD Score: sc h 0.8578±0.00945556
Z-Score: -5.8468±0.105538
p-Value: 0.00000000550776
Z-Factor: 0.0182173
Fitness Defect: 19.0171
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:21|G11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2008-05-08 YYYY-MM-DD
Plate CH Control (+):0.040475±0.00066
Plate DMSO Control (-):0.587675±0.02128
Plate Z-Factor:0.8804
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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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