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Compound InformationSONAR Target prediction
Name:

TETRAHYDROCORTISONE-21-ACETATE

Unique Identifier:SPE01701048
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C23H34O6
Molecular Weight:373.25 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC(=O)OCC(=O)C1(O)CCC2C3CCC4CC(O)CCC4(C)C3C(=O)CC21C
Class:sterol
Source:derivative microbial degradation of cortisone
Reference:Z Naturforsch B 18: 284 (1963)

Found: 91 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [91]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.7390±0.00869741
Normalized OD Score: sc h 1.0156±0.00748938
Z-Score: 0.8255±0.379847
p-Value: 0.425728
Z-Factor: -4.35871
Fitness Defect: 0.854
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|B6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.040475±0.00119
Plate DMSO Control (-):0.70815±0.01282
Plate Z-Factor:0.9284
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 7027 | Additional Members: 5 | Rows returned: 4
SPE01701047 0.428571428571429
Prest1189 0.291666666666667
Prest1190 0
LOPAC 01140 0

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