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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 2 3 4 5 6 7 8 9 10  Next >> [28]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.6433±0.00586899
Normalized OD Score: sc h 0.9024±0.00622931
Z-Score: -5.1795±0.216657
p-Value: 0.000000298474
Z-Factor: 0.26262
Fitness Defect: 15.0246
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.039825±0.00080
Plate DMSO Control (-):0.704425±0.01217
Plate Z-Factor:0.9392
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 15563 | Additional Members: 8 | Rows returned: 2
SPE01504130 0.375
SPE01502247 0

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