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Compound InformationSONAR Target prediction
Name:

MECLOCYCLINE SULFOSALICYLATE

Unique Identifier:SPE01501118
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:667.834 g/mol
X log p:3.869  (online calculus)
Lipinksi Failures0
TPSA54.45
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:2
Canonical Smiles:CN(C)C1C2C(O)C3C(=C)c4c(Cl)ccc(O)c4C(=O)C3=C(O)C2(O)C(=O)C(C(N)=O)=C1O
.OC(=O)c1cc(ccc1O)S(O)(=O)=O
Source:semisynthetic; GS-2989, NSC-78502
Therapeutics:antibacterial

Found: 201 nonactive | as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [201]
Species: 4932
Condition: GBP2
Replicates: 2
Raw OD Value: r im 0.6635±0.00452548
Normalized OD Score: sc h 0.9350±0.00301062
Z-Score: -2.8529±0.192008
p-Value: 0.0046933
Z-Factor: -0.365982
Fitness Defect: 5.3616
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:2|A9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.00 Celcius
Date:2008-03-26 YYYY-MM-DD
Plate CH Control (+):0.040275±0.00038
Plate DMSO Control (-):0.68875±0.01703
Plate Z-Factor:0.9299
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2358 | Additional Members: 14 | Rows returned: 4
Prest588 0.465909090909091
Prest1251 0.406976744186046
Prest1072 0
SPE01500266 0

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