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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: RPN1
Replicates: 2
Raw OD Value: r im 0.5144±0.0339411
Normalized OD Score: sc h 0.7882±0.0501513
Z-Score: -10.7431±2.31803
p-Value: 4.35428e-20
Z-Factor: -0.0900567
Fitness Defect: 44.5805
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.50 Celcius
Date:2008-05-28 YYYY-MM-DD
Plate CH Control (+):0.040375±0.00110
Plate DMSO Control (-):0.638925±0.01692
Plate Z-Factor:0.9242
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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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