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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 11 12 13 14 15 16 17 18 19 20  Next >> [201]
Species: 4932
Condition: DCC1
Replicates: 2
Raw OD Value: r im 0.5860±0.00905097
Normalized OD Score: sc h 0.9359±0.0112371
Z-Score: -2.9541±0.592865
p-Value: 0.00599634
Z-Factor: -0.74842
Fitness Defect: 5.1166
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:2|A9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.40 Celcius
Date:2008-06-25 YYYY-MM-DD
Plate CH Control (+):0.040125±0.00101
Plate DMSO Control (-):0.629075±0.01732
Plate Z-Factor:0.9116
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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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