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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 61 62 63 64 65 66 67 68 69 70  Next >> [114]
Species: 4932
Condition: MET16
Replicates: 2
Raw OD Value: r im 0.6731±0.00240416
Normalized OD Score: sc h 1.0020±0.00552184
Z-Score: 0.0979±0.278026
p-Value: 0.84488
Z-Factor: -26.8081
Fitness Defect: 0.1686
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:17|A8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2007-10-18 YYYY-MM-DD
Plate CH Control (+):0.0411±0.00108
Plate DMSO Control (-):0.6575249999999999±0.01960
Plate Z-Factor:0.9145
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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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