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Compound InformationSONAR Target prediction
Name:

ALCLOMETAZONE DIPROPIONATE

Unique Identifier:SPE01505125
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C28ClH37O7
Molecular Weight:483.748 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CCC(=O)OCC(=O)C1(OC(=O)CC)C(C)CC2C3C(Cl)CC4=CC(=O)C=CC4(C)C3C(O)CC21C
Source:semisynthetic; SCH-22219
Therapeutics:antiinflammatory, glucocorticoid

Found: 91 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [91]
Species: 4932
Condition: FET3
Replicates: 2
Raw OD Value: r im 0.7063±0.00763675
Normalized OD Score: sc h 1.0165±0.000257218
Z-Score: 0.6864±0.0124248
p-Value: 0.492488
Z-Factor: -3.81541
Fitness Defect: 0.7083
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:9|D2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.80 Celcius
Date:2008-01-10 YYYY-MM-DD
Plate CH Control (+):0.04095±0.00097
Plate DMSO Control (-):0.67845±0.01480
Plate Z-Factor:0.9305
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 17014 | Additional Members: 17 | Rows returned: 141 2 3 Next >> 
Prest1079 0.577319587628866
Prest1284 0.454545454545455
LOPAC 00729 0.425287356321839
Prest840 0.425287356321839
LAT003F07 0.425287356321839
SPE01500813 0.425287356321839

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