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Compound InformationSONAR Target prediction
Name:

7-HYDROXY-8,4`-DIMETHOXYISOFLAVONE

Unique Identifier:SPE00201185
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17H14O5
Molecular Weight:284.179 g/mol
X log p:15.443  (online calculus)
Lipinksi Failures1
TPSA44.76
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:3
Canonical Smiles:COc1ccc(cc1)C1=COc2c(OC)c(O)ccc2C1=O
Source:semisynthetic analog

Found: 495 nonactive | as graph: single | with analogs [1] << Back 471 472 473 474 475 476 477 478 479 480  Next >> [495]
Species: 4932
Condition: ROT2
Replicates: 2
Raw OD Value: r im 0.7722±0.000494975
Normalized OD Score: sc h 0.9204±0.00109253
Z-Score: -3.7599±0.000876329
p-Value: 0.000169966
Z-Factor: -0.183136
Fitness Defect: 8.6799
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:5|A5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.30 Celcius
Date:2006-05-05 YYYY-MM-DD
Plate CH Control (+):0.03825±0.00246
Plate DMSO Control (-):0.814375±0.02354
Plate Z-Factor:0.8994
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DBLink | Rows returned: 1
5319771 7-hydroxy-8-methoxy-3-(4-methoxyphenyl)chromen-4-one

internal high similarity DBLink | Rows returned: 4
SPE00240645 0.9407
SPE00201341 0.9571
SPE00200139 0.9710
SPE00201312 0.9926

active | Cluster 5360 | Additional Members: 5 | Rows returned: 3
SPE00200139 0.440677966101695
SPE00240645 0.288461538461538
SPE00201312 0

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