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Compound InformationSONAR Target prediction
Name:

Imperatorin

Unique Identifier:LAT001C03
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H14O4
Molecular Weight:256.169 g/mol
X log p:13.312  (online calculus)
Lipinksi Failures1
TPSA44.76
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:CC(C)=CCOc1c2occc2cc2C=CC(=O)Oc12

Found: 1 active | as graph: single | with analogs
Species: 4932
Condition: wt18h
Replicates: 2
Raw OD Value: r im 0.6089±0.0144957
Normalized OD Score: sc h 0.7722±0.0159612
Z-Score: -6.3848±0.685217
p-Value: 0.00000000181795
Z-Factor: 0.519179
Fitness Defect: 20.1256
Bioactivity Statement: Active
Experimental Conditions
Library:LATCA
Plate Number and Position:1|C3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.60 Celcius
Date:2007-02-28 YYYY-MM-DD
Plate CH Control (+):0.04045±0.00170
Plate DMSO Control (-):0.805925±0.01622
Plate Z-Factor:0.9334
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DBLink | Rows returned: 1
10212

internal high similarity DBLink | Rows returned: 1
SPE00102076 1.0000

active | Cluster 12807 | Additional Members: 6 | Rows returned: 3
SPE00300005 0.474576271186441
SPE00102076 0.305084745762712
SPE01500400 0

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