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Compound InformationSONAR Target prediction
Name:

Idarubicin

Unique Identifier:LOPAC 00975
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C26H27NO9
Molecular Weight:471.287 g/mol
X log p:4.988  (online calculus)
Lipinksi Failures0
TPSA69.67
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:3
Canonical Smiles:CC1OC(CC(N)C1O)OC1CC(O)(Cc2c(O)c3c(=O)c4ccccc4c(=O)c3c(O)c12)C(C)=O
Class:DNA Metabolism
Action:Inhibitor

Found: 24 active as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.1088±0.00692985
Normalized OD Score: sc h 0.1430±0.0123836
Z-Score: -28.9449±9.66497
p-Value: 0
Z-Factor: 0.752502
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:Lopac
Plate Number and Position:8|D11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.046637500000000005±0.00115
Plate DMSO Control (-):0.7662749999999999±0.04402
Plate Z-Factor:0.9298
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DBLink | Rows returned: 1
42890 (7S,9S)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-oxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydr
o-7H-tetracene-5,12-dione

internal high similarity DBLink | Rows returned: 0

active | Cluster 5481 | Additional Members: 8 | Rows returned: 5
SPE01500223 0.172043010752688
Prest791 0.172043010752688
SPE01505483 0
SPE01505708 0
Prest188 0

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