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Compound InformationSONAR Target prediction
Name:

GERALDOL

Unique Identifier:SPE01505149
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H12O6
Molecular Weight:288.168 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1cc(ccc1O)C1Oc2cc(O)ccc2C(=O)C=1O
Class:flavone
Source:Lotus corniculatus, Tetragonolobus siliquosus, Anthyllis vulneraria, Trifolium
subterraneum
Reference:Ber 48:85 (1915); Biochem J 60:582 (1955)

Found: 28 active | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [28]
Species: 4932
Condition: KEM1
Replicates: 2
Raw OD Value: r im 0.5154±0.0208596
Normalized OD Score: sc h 0.8599±0.0307684
Z-Score: -5.7396±0.987293
p-Value: 0.00000023101
Z-Factor: -0.335831
Fitness Defect: 15.2808
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2008-05-08 YYYY-MM-DD
Plate CH Control (+):0.040675±0.00064
Plate DMSO Control (-):0.5839000000000001±0.01889
Plate Z-Factor:0.9082
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 15563 | Additional Members: 8 | Rows returned: 3
SPE01500732 0.433962264150943
SPE01504130 0.375
SPE01502247 0

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