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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 21 22 23 24 25 26 27 28 29 30  Next >> [104]
Species: 4932
Condition: GBP2
Replicates: 2
Raw OD Value: r im 0.7133±0.00233345
Normalized OD Score: sc h 1.0288±0.000116759
Z-Score: 1.2573±0.0342926
p-Value: 0.208758
Z-Factor: -6.30659
Fitness Defect: 1.5666
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|E8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.20 Celcius
Date:2008-03-26 YYYY-MM-DD
Plate CH Control (+):0.04035±0.00062
Plate DMSO Control (-):0.6588±0.03244
Plate Z-Factor:0.8348
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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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