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Compound InformationSONAR Target prediction
Name:

TYRAMINE

Unique Identifier:SPE00210400
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:126.092 g/mol
X log p:7.831  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:2
Canonical Smiles:NCCc1ccc(O)cc1
Class:alkaloid
Source:widespread in plants
Therapeutics:adrenergic agonist

Found: 205 nonactive as graph: single | with analogs [1] << Back 201 202 203 204 205 Next >> [205]
Species: 4932
Condition: NPR1
Replicates: 2
Raw OD Value: r im 0.9305±0.0000707107
Normalized OD Score: sc h 0.9527±0.0055027
Z-Score: -0.1181±0.443263
p-Value: 0.755604
Z-Factor: -1.39183
Fitness Defect: 0.2802
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:16|D10
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.000475±0.00322
Plate DMSO Control (-):0.998575±0.03329
Plate Z-Factor:0.8988
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DBLink | Rows returned: 5
5610 4-(2-aminoethyl)phenol
66449 4-(2-aminoethyl)phenol hydrochloride
450788 4-(2-aminoethyl)phenol
2753339 4-(2-aminoethyl)phenol hydrochloride
5249538 2-(4-hydroxyphenyl)ethylazanium

internal high similarity DBLink | Rows returned: 1
LOPAC 00260 1.0000

active | Cluster 5045 | Additional Members: 7 | Rows returned: 1
LOPAC 00264 0.454545454545455

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