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Compound InformationSONAR Target prediction
Name:

FRAXETIN

Unique Identifier:SPE01504069
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H8O5
Molecular Weight:200.104 g/mol
X log p:7.161  (online calculus)
Lipinksi Failures1
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:COc1cc2C=CC(=O)Oc2c(O)c1O
Source:ex Fraxinus, Peltogyne and Hydrangea spp
Reference:Ber 62: 120 (1929)

Found: 113 nonactive | as graph: single | with analogs [1] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [113]
Species: 4932
Condition: GAS1
Replicates: 2
Raw OD Value: r im 0.3451±0.0301935
Normalized OD Score: sc h 1.0509±0.00803324
Z-Score: 0.5117±0.133045
p-Value: 0.610418
Z-Factor: -2.99821
Fitness Defect: 0.4936
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:6|A7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.90 Celcius
Date:2006-01-20 YYYY-MM-DD
Plate CH Control (+):0.043425000000000005±0.00154
Plate DMSO Control (-):0.3497±0.02233
Plate Z-Factor:0.6989
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DBLink | Rows returned: 1
5273569 7,8-dihydroxy-6-methoxy-chromen-2-one

internal high similarity DBLink | Rows returned: 5
SPE01500899 0.9167
LOPAC 00840 0.9375
SPE00100572 0.9412
NRB 03190 0.9495
SPE01502242 0.9688

active | Cluster 2974 | Additional Members: 2 | Rows returned: 0
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