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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 91 92 93 94 95 96 97 98 99 100  Next >> [114]
Species: 4932
Condition: RPN10
Replicates: 2
Raw OD Value: r im 0.6694±0.0169706
Normalized OD Score: sc h 0.9891±0.0130942
Z-Score: -0.5450±0.654591
p-Value: 0.62404
Z-Factor: -88.1406
Fitness Defect: 0.4715
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:17|A8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.30 Celcius
Date:2007-09-28 YYYY-MM-DD
Plate CH Control (+):0.041975±0.00159
Plate DMSO Control (-):0.6815749999999999±0.02685
Plate Z-Factor:0.8493
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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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