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Compound InformationSONAR Target prediction
Name:

CHLORTETRACYCLINE HYDROCHLORIDE

Unique Identifier:SPE01500829
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C22Cl2H24N2O8
Molecular Weight:491.149 g/mol
X log p:3.2  (online calculus)
Lipinksi Failures0
TPSA54.45
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:2
Canonical Smiles:Cl.CN(C)C1C2CC3C(=C(O)C2(O)C(=O)C(C(N)=O)=C1O)C(=O)c1c(O)ccc(Cl)c1C3(C
)O
Source:ex Strptomyces aureofaciens
Reference:Ann NY Acad Sci 51: 177 (1948); JACS 74: 4976 (1952); 76: 3568 (1954)
Therapeutics:antibiotic
Generic_name:7-CHLOROTETRACYCLINE
Chemical_iupac_name:7-CHLOROTETRACYCLINE
Drug_type:Experimental
Drugbank_id:EXPT01049
Drug_category:Tetracycline Repressor inhibitor
Organisms_affected:-1

Found: 101 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [101]
Species: 4932
Condition: CKA2
Replicates: 2
Raw OD Value: r im 0.8413±0.00169706
Normalized OD Score: sc h 0.9973±0.000224647
Z-Score: -0.0956±0.00370284
p-Value: 0.923872
Z-Factor: -31.3366
Fitness Defect: 0.0792
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:24|G6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2006-04-03 YYYY-MM-DD
Plate CH Control (+):0.040125±0.00110
Plate DMSO Control (-):0.8250500000000001±0.01727
Plate Z-Factor:0.9269
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 5
SPE01500457 0.9146
SPE01500566 0.9298
LOPAC 00845 1.0000
SPE01500186 1.0000
SPE01500226 1.0000

nonactive | Cluster 12393 | Additional Members: 20 | Rows returned: 161 2 3 Next >> 
LOPAC 00607 0.554347826086957
LAT004C03 0.554347826086957
SPE01505684 0.452631578947368
SPE01500414 0.448275862068966
Prest626 0.448275862068966
Prest235 0.353658536585366

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