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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 171 172 173 174 175 176 177 178 179 180  Next >> [205]
Species: 4932
Condition: SSB2
Replicates: 2
Raw OD Value: r im 0.6814±0.00289914
Normalized OD Score: sc h 1.0004±0.00736263
Z-Score: 0.0185±0.40576
p-Value: 0.774214
Z-Factor: -39.2715
Fitness Defect: 0.2559
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|G7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.20 Celcius
Date:2008-05-29 YYYY-MM-DD
Plate CH Control (+):0.040374999999999994±0.00082
Plate DMSO Control (-):0.67435±0.01078
Plate Z-Factor:0.9537
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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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