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Compound InformationSONAR Target prediction
Name:

Adrenosterone

Unique Identifier:Prest1155
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C19H24O3
Molecular Weight:279.225 g/mol
X log p:-0.0529999999999999  (online calculus)
Lipinksi Failures0
TPSA51.21
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:0
Canonical Smiles:CC12CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2=O

Found: 3 nonactive as graph: single | with analogs 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 781.0000±0
Normalized OD Score: sc h 0.8604±0
Z-Score: -3.1472±0
p-Value: 0.00164864
Z-Factor: -5.77605
Fitness Defect: 6.4078
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:12|B10
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.30 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):758.5±653.58671
Plate DMSO Control (-):822.5±277.54018
Plate Z-Factor:-66.6597
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DBLink | Rows returned: 17<< Back 1 2 3
7059674 (8S,9R,10S,13R,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-tr
ione
7059675 (8R,9R,10S,13R,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-tr
ione
7103194 (5S,8R,9R,10S,13R,14R)-10,13-dimethyl-4,5,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17
-trione
7103195 (5S,8R,9R,10S,13S,14R)-10,13-dimethyl-4,5,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17
-trione
7103196 (5S,8R,9S,10S,13S,14R)-10,13-dimethyl-4,5,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17
-trione

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 11390 | Additional Members: 8 | Rows returned: 6
Prest648 0.58695652173913
SPE01500207 0.232876712328767
LOPAC 00764 0.232876712328767
Prest132 0
LOPAC 00761 0
SPE01701028 0

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