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Compound InformationSONAR Target prediction
Name:

DANTHRON

Unique Identifier:SPE00211468
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:232.147 g/mol
X log p:11.828  (online calculus)
Lipinksi Failures1
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:Oc1cccc2c(=O)c3cccc(O)c3c(=O)c12
Class:quinone
Source:Rheum palmatum, Xyris semifuscata
Reference:JACS 53: 4112 (1931)
Therapeutics:cathartic

Found: 70 nonactive | as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70 Next >> [70]
Species: 4932
Condition: SRL3
Replicates: 2
Raw OD Value: r im 0.6891±0.00190919
Normalized OD Score: sc h 0.9702±0.000537403
Z-Score: -1.6970±0.0203077
p-Value: 0.089724
Z-Factor: -2.63576
Fitness Defect: 2.411
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:25|H11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.00 Celcius
Date:2008-09-17 YYYY-MM-DD
Plate CH Control (+):0.04227500000000001±0.00122
Plate DMSO Control (-):0.69465±0.01775
Plate Z-Factor:0.9170
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DBLink | Rows returned: 1
2950 1,8-dihydroxyanthracene-9,10-dione

internal high similarity DBLink | Rows returned: 0

active | Cluster 7565 | Additional Members: 10 | Rows returned: 5
SPE00300038 0.564102564102564
SPE01505129 0.475
SPE00300545 0.35
LAT015F08 0.333333333333333
LAT005A05 0

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