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Compound InformationSONAR Target prediction
Name:

Tryptamine hydrochloride

Unique Identifier:LOPAC 00557
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10ClH13N2
Molecular Weight:183.573 g/mol
X log p:9.835  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:2
Canonical Smiles:Cl.NCCc1cnc2ccccc12
Class:Serotonin
Action:Ligand

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6206±0.00268701
Normalized OD Score: sc h 0.9660±0.0027104
Z-Score: -1.0238±0.0417637
p-Value: 0.30615
Z-Factor: -22.9743
Fitness Defect: 1.1837
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|G2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.05145±0.00553
Plate DMSO Control (-):0.6681999999999999±0.07984
Plate Z-Factor:0.5918
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 3
AC 15867 0.9048
JFD 03937 0.9194
SPE01503922 1.0000

nonactive | Cluster 17959 | Additional Members: 13 | Rows returned: 3
LAT006H07 0.409090909090909
SPE01505331 0.405405405405405
SPE01503922 0

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