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Compound InformationSONAR Target prediction
Name:

GOSSYPETIN

Unique Identifier:SPE01505143
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H10O8
Molecular Weight:308.156 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Oc1ccc(cc1O)C1Oc2c(O)c(O)cc(O)c2C(=O)C=1O
Class:flavone
Source:widespread in plants
Reference:J Chem Soc 1929:24

Found: 102 nonactive | as graph: single | with analogs [1] << Back 101 102
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.4541±0.0132936
Normalized OD Score: sc h 0.9189±0.00526218
Z-Score: -2.2742±0.15097
p-Value: 0.0237324
Z-Factor: -1.41471
Fitness Defect: 3.7409
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|B11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-06-05 YYYY-MM-DD
Plate CH Control (+):0.0407±0.00103
Plate DMSO Control (-):0.49019999999999997±0.03974
Plate Z-Factor:0.9050
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 10732 | Additional Members: 22 | Rows returned: 71 2 Next >> 
RJC 00213 0.508196721311475
SPE01502259 0.421052631578947
Prest342 0.326923076923077
LOPAC 01061 0.326923076923077
Prest1133 0.224489795918367
Prest541 0

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