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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: 1 active | as graph: single | with analogs
Species: 4932
Condition: RBL2
Replicates: 2
Raw OD Value: r im 0.7675±0.00106066
Normalized OD Score: sc h 1.0789±0.00127441
Z-Score: 4.4257±0.000231868
p-Value: 0.000009613
Z-Factor: 0.219318
Fitness Defect: 11.5524
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:15|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-06-03 YYYY-MM-DD
Plate CH Control (+):0.040175±0.00060
Plate DMSO Control (-):0.7111000000000001±0.01523
Plate Z-Factor:0.9100
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 11774 | Additional Members: 14 | Rows returned: 81 2 Next >> 
SPE00107108 0.377049180327869
SPE00107113 0.353846153846154
SPE00100586 0.275862068965517
SPE00310009 0
Prest1062 0
Prest689 0

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