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Compound InformationSONAR Target prediction
Name:

Oxytetracycline dihydrate

Unique Identifier:Prest630
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C22H28N2O11
Molecular Weight:470.258 g/mol
X log p:3.847  (online calculus)
Lipinksi Failures1
TPSA54.45
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:11
Rotatable Bond Count:2
Canonical Smiles:O.O.CN(C)C1C2C(O)C3C(=C(O)C2(O)C(=O)C(C(N)=O)=C1O)C(=O)c1c(O)cccc1C3(C
)O

Found: 3 nonactive as graph: single | with analogs << Back 1 2 3
Species: 9606
Condition: TMPPre003
Replicates: 2
Raw OD Value: r im 15800.0000±0
Normalized OD Score: sc h 0.8798±0
Z-Score: -3.3441±0
p-Value: 0.000825598
Z-Factor: -2.7906
Fitness Defect: 7.0994
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:4|G8
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.70 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):18451.5±2414.05033
Plate DMSO Control (-):18390±2336.55654
Plate Z-Factor:-30.8248
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 2358 | Additional Members: 14 | Rows returned: 111 2 Next >> 
LAT002C08 0.465909090909091
SPE01501118 0.465909090909091
LAT002E08 0.406976744186046
SPE01501104 0.406976744186046
Prest1251 0.406976744186046
SPE01500457 0.353658536585366

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