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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 71 72 73 74 75 76 77 78 79 80  Next >> [92]
Species: 4932
Condition: SNC1
Replicates: 2
Raw OD Value: r im 0.6819±0.0181019
Normalized OD Score: sc h 0.9686±0.0349403
Z-Score: -1.8144±2.02677
p-Value: 0.352106
Z-Factor: -6.15767
Fitness Defect: 1.0438
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:21|G2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.80 Celcius
Date:2008-04-24 YYYY-MM-DD
Plate CH Control (+):0.04095±0.00063
Plate DMSO Control (-):0.7022±0.02205
Plate Z-Factor:0.8808
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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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