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Compound InformationSONAR Target prediction
Name:

3-Iodo-L-tyrosine

Unique Identifier:LOPAC 00584
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9H10INO3
Molecular Weight:298.014 g/mol
X log p:5.784  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:NC(Cc1ccc(O)c(I)c1)C(O)=O
Class:Neurotransmission
Action:Inhibitor
Selectivity:Tyrosine hydroxylase
Generic_name:3-IODO-TYROSINE
Chemical_iupac_name:3-IODO-TYROSINE
Drug_type:Experimental
Drugbank_id:EXPT01951
Drug_category:Sst1-Selective Somatosatin Analog inhibitor
Organisms_affected:-1

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6704±0.0388909
Normalized OD Score: sc h 1.0180±0.0322387
Z-Score: 0.4867±0.909149
p-Value: 0.56728
Z-Factor: -5.63987
Fitness Defect: 0.5669
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:9|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.046225±0.00775
Plate DMSO Control (-):0.6777±0.06033
Plate Z-Factor:0.6382
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DBLink | Rows returned: 81 2 Next >> 
6272 2-amino-3-(4-hydroxy-3-iodo-phenyl)propanoic acid
123751 2-amino-3-(4-hydroxy-3-iodo-phenyl)-2-methyl-propanoic acid
172981 (2S)-2-amino-3-(4-hydroxy-3-iodo-phenyl)propanoic acid
439744 (2S)-2-amino-3-(4-hydroxy-3-iodo-phenyl)propanoic acid
450432 (2R)-2-amino-3-(4-hydroxy-3-iodo-phenyl)-2-methyl-propanoic acid
450433 (2R)-2-amino-3-(4-hydroxy-3-iodo-phenyl)-2-methyl-propanoic acid

internal high similarity DBLink | Rows returned: 0

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

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