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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 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: CLN3
Replicates: 2
Raw OD Value: r im 0.7335±0.0209304
Normalized OD Score: sc h 1.0849±0.00384394
Z-Score: 2.9451±0.34967
p-Value: 0.00419444
Z-Factor: -1.07693
Fitness Defect: 5.474
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|G2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.80 Celcius
Date:2005-05-08 YYYY-MM-DD
Plate CH Control (+):0.047725000000000004±0.00049
Plate DMSO Control (-):0.6973750000000001±0.05506
Plate Z-Factor:0.7382
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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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