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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 1 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 1782.0000±0
Normalized OD Score: sc h 0.8791±0
Z-Score: -2.7256±0
p-Value: 0.0064182
Z-Factor: -86.6324
Fitness Defect: 5.0486
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 (+):1024±959.34887
Plate DMSO Control (-):2047±547.49039
Plate Z-Factor:-4.6829
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2358 | Additional Members: 14 | Rows returned: 5
Prest588 0.465909090909091
SPE01501118 0.465909090909091
Prest1251 0.406976744186046
Prest1072 0
SPE01500266 0

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