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Compound InformationSONAR Target prediction
Name:

L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride

Unique Identifier:LOPAC 00822
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10ClH14NO4
Molecular Weight:233.564 g/mol
X log p:6.221  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:4
Canonical Smiles:Cl.COC(=O)C(N)Cc1ccc(O)c(O)c1
Class:Dopamine
Action:Precursor

Found: 24 nonactive as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.8068±0.0864211
Normalized OD Score: sc h 0.9901±0.04138
Z-Score: -0.2648±1.3713
p-Value: 0.40721
Z-Factor: -33.2181
Fitness Defect: 0.8984
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:5|D7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.60 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.04706875±0.00209
Plate DMSO Control (-):0.7644374999999999±0.04321
Plate Z-Factor:0.8209
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DBLink | Rows returned: 7<< Back 1 2
6942173 [(1R)-2-(3,4-dihydroxyphenyl)-1-methoxycarbonyl-ethyl]azanium

internal high similarity DBLink | Rows returned: 3
BTB 06642 0.9077
LOPAC 01043 0.9077
RJC 01672 0.9077

active | Cluster 12980 | Additional Members: 10 | Rows returned: 2
SPE01502206 0.55
LOPAC 01089 0.55

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