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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 71 72 73 74 75 76 77 78 79 80  Next >> [205]
Species: 4932
Condition: ROT2
Replicates: 2
Raw OD Value: r im 0.8162±0.00898026
Normalized OD Score: sc h 0.9994±0.00125803
Z-Score: -0.0291±0.0598129
p-Value: 0.966278
Z-Factor: -16.6438
Fitness Defect: 0.0343
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:7|E2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.30 Celcius
Date:2006-05-05 YYYY-MM-DD
Plate CH Control (+):0.037675±0.00276
Plate DMSO Control (-):0.8077000000000001±0.02004
Plate Z-Factor:0.9108
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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

nonactive | Cluster 5045 | Additional Members: 7 | Rows returned: 6
LOPAC 00260 0.533333333333333
LOPAC 00864 0.529411764705882
LOPAC 00268 0.5
LOPAC 00264 0.454545454545455
SPE01500263 0
LOPAC 00261 0

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