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Compound InformationSONAR Target prediction
Name:

Lysergol

Unique Identifier:Prest308
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H18N2O
Molecular Weight:237.192 g/mol
X log p:9.901  (online calculus)
Lipinksi Failures1
TPSA3.24
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:CN1CC(CO)C=C2C1Cc1cnc3cccc2c13

Found: 1 active | as graph: single | with analogs
Species: 9606
Condition: TMPPre003
Replicates: 2
Raw OD Value: r im 14924.0000±0
Normalized OD Score: sc h 0.8177±0
Z-Score: -5.0719±0
p-Value: 0.00000039375
Z-Factor: -1.4738
Fitness Defect: 14.7475
Bioactivity Statement: Active
Experimental Conditions
Library:Prestwick
Plate Number and Position:6|F5
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:24.00 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):18603±2417.22394
Plate DMSO Control (-):18347.5±2353.75180
Plate Z-Factor:-21.3877
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 4543 | Additional Members: 12 | Rows returned: 0
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