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Compound InformationSONAR Target prediction
Name:

Antimycin A

Unique Identifier:Prest922
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C28H40N2O9
Molecular Weight:509.316 g/mol
X log p:6.022  (online calculus)
Lipinksi Failures3
TPSA113.04
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:11
Rotatable Bond Count:14
Canonical Smiles:CCCCCCC1C(OC(=O)CC(C)C)C(C)OC(=O)C(NC(=O)c2cccc(NC=O)c2O)C(C)OC1=O

Found: 3 nonactive as graph: single | with analogs << Back 1 2 3
Species: 9606
Condition: TMPPre003
Replicates: 2
Raw OD Value: r im 16214.0000±0
Normalized OD Score: sc h 0.8602±0
Z-Score: -3.8898±0
p-Value: 0.000100344
Z-Factor: -1.0122
Fitness Defect: 9.2069
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:3|G3
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.60 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):18357.5±2177.01332
Plate DMSO Control (-):18529.5±1551.44299
Plate Z-Factor:-61.5880
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DBLink | Rows returned: 21<< Back 1 2 3 4
7067443 [(2S,3R,6S,7S,8S)-3-[(3-formamido-2-hydroxy-benzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7
-yl] 3-methylbutanoate
7067444 [(2S,3R,6S,7R,8R)-3-[(3-formamido-2-hydroxy-benzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7
-yl] 3-methylbutanoate
7067445 [(2S,3R,6S,7R,8S)-3-[(3-formamido-2-hydroxy-benzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7
-yl] 3-methylbutanoate

internal high similarity DBLink | Rows returned: 0

active | Cluster 5241 | Additional Members: 4 | Rows returned: 1
SPE01502108 0

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