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Compound InformationSONAR Target prediction
Name:

ANDROSTERONE SODIUM SULFATE

Unique Identifier:SPE01503675
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C19H29NaO5S
Molecular Weight:364.264 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:[Na+].[O-]S(=O)(=O)OC1CCC2(C)C(CCC3C2CCC2(C)C3CCC2=O)C1
Source:semisynthetic
Therapeutics:menstrual regulation

Found: 90 nonactive | as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [90]
Species: 4932
Condition: SSB2
Replicates: 2
Raw OD Value: r im 0.7193±0.00169706
Normalized OD Score: sc h 1.0361±0.00226795
Z-Score: 1.9806±0.126598
p-Value: 0.04853
Z-Factor: -0.414374
Fitness Defect: 3.0256
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:15|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.40 Celcius
Date:2008-05-29 YYYY-MM-DD
Plate CH Control (+):0.04015±0.00054
Plate DMSO Control (-):0.68065±0.01115
Plate Z-Factor:0.9606
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 11774 | Additional Members: 14 | Rows returned: 5
SPE00107108 0.377049180327869
SPE00107113 0.353846153846154
SPE00100586 0.275862068965517
SPE00310009 0
LOPAC 00697 0

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