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Compound InformationSONAR Target prediction
Name:

MINOCYCLINE HYDROCHLORIDE

Unique Identifier:SPE01500414
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C23ClH28N3O7
Molecular Weight:467.731 g/mol
X log p:4.195  (online calculus)
Lipinksi Failures0
TPSA57.69
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:3
Canonical Smiles:Cl.CN(C)C1C2CC3Cc4c(ccc(O)c4C(=O)C3=C(O)C2(O)C(=O)C(C(N)=O)=C1O)N(C)C
Therapeutics:antibacterial

Found: 114 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [114]
Species: 4932
Condition: BY4741-3rd
Replicates: 2
Raw OD Value: r im 0.9200±0.0206475
Normalized OD Score: sc h 1.0025±0.0214884
Z-Score: 0.7419±0.90153
p-Value: 0.54233
Z-Factor: -8.3459
Fitness Defect: 0.6119
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:4|A2
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09249999999999999±0.00289
Plate DMSO Control (-):0.9575±0.03143
Plate Z-Factor:0.9267
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 12393 | Additional Members: 20 | Rows returned: 161 2 3 Next >> 
LOPAC 00607 0.554347826086957
LAT004C03 0.554347826086957
SPE01505684 0.452631578947368
Prest626 0.448275862068966
Prest235 0.353658536585366
LAT001B08 0.353658536585366

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