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Compound InformationSONAR Target prediction
Name:

DALBERGIONE

Unique Identifier:SPE00201281
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:212.159 g/mol
X log p:18.209  (online calculus)
Lipinksi Failures1
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:3
Canonical Smiles:C=CC(c1ccccc1)c1cc(=O)ccc1=O
Class:quinone
Source:Dalbergia spp

Found: 546 nonactive | as graph: single | with analogs [1] << Back 521 522 523 524 525 526 527 528 529 530  Next >> [546]
Species: 4932
Condition: SWE1
Replicates: 2
Raw OD Value: r im 0.7069±0.0204354
Normalized OD Score: sc h 0.9681±0.00146238
Z-Score: -1.9048±0.111262
p-Value: 0.0575742
Z-Factor: -0.517377
Fitness Defect: 2.8547
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:14|E11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.20 Celcius
Date:2008-05-13 YYYY-MM-DD
Plate CH Control (+):0.041374999999999995±0.00264
Plate DMSO Control (-):0.6988000000000001±0.01639
Plate Z-Factor:0.8978
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DBLink | Rows returned: 1
99926 2-methoxy-5-(1-phenylprop-2-enyl)cyclohexa-2,5-diene-1,4-dione

internal high similarity DBLink | Rows returned: 0

active | Cluster 9726 | Additional Members: 2 | Rows returned: 1
SPE00240828 0.557692307692308

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