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Compound InformationSONAR Target prediction
Name:

PREGNENOLONE SUCCINATE

Unique Identifier:SPE01505713
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C25H36O5
Molecular Weight:380.264 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)C1CCC2C3CC=C4CC(CCC4(C)C3CCC21C)OC(=O)CCC(O)=O
Source:semisynthetic
Therapeutics:glucocortcoid, antiinflammatory

Found: 92 nonactive | as graph: single | with analogs [1] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [92]
Species: 4932
Condition: GCN3
Replicates: 2
Raw OD Value: r im 0.6561±0.00417193
Normalized OD Score: sc h 0.9622±0.00485681
Z-Score: -1.8723±0.271403
p-Value: 0.065934
Z-Factor: -1.117
Fitness Defect: 2.7191
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:21|G2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.10 Celcius
Date:2007-12-11 YYYY-MM-DD
Plate CH Control (+):0.043300000000000005±0.00104
Plate DMSO Control (-):0.6588499999999999±0.01301
Plate Z-Factor:0.9404
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 7902 | Additional Members: 9 | Rows returned: 3
SPE01505123 0.435897435897436
SPE00270029 0.405797101449275
SPE01500645 0.276923076923077

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