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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: 2 nonactive | as graph: single | with analogs 1 2 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 1909.0000±0
Normalized OD Score: sc h 0.9138±0
Z-Score: -1.9425±0
p-Value: 0.052078
Z-Factor: -579.926
Fitness Defect: 2.955
Bioactivity Statement: Nonactive
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 (+):1009.5±953.84240
Plate DMSO Control (-):2021±558.06298
Plate Z-Factor:-4.4864
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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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