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Compound InformationSONAR Target prediction
Name:

DAPHNETIN

Unique Identifier:SPE01504141
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9H6O4
Molecular Weight:172.094 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Oc1ccc2C=CC(=O)Oc2c1O
Source:Daphne odora
Reference:Biochem Biophys Res Comm 260: 682 (1999)
Therapeutics:PK inhibitor, antimalarial

Found: 104 nonactive as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [104]
Species: 4932
Condition: VBA3
Replicates: 2
Raw OD Value: r im 0.6882±0.011243
Normalized OD Score: sc h 1.0122±0.0110117
Z-Score: 0.6373±0.573449
p-Value: 0.556894
Z-Factor: -5.10576
Fitness Defect: 0.5854
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|E8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.40 Celcius
Date:2008-03-12 YYYY-MM-DD
Plate CH Control (+):0.041±0.00038
Plate DMSO Control (-):0.6543000000000001±0.01368
Plate Z-Factor:0.9233
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 16396 | Additional Members: 2 | Rows returned: 0
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