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Compound InformationSONAR Target prediction
Name:

p-CHLOROPHENYLALANINE

Unique Identifier:SPE01502162
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:189.555 g/mol
X log p:7.634  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:3
Canonical Smiles:NC(Cc1ccc(Cl)cc1)C(O)=O
Source:synthetic
Therapeutics:Irreversible inhibitor of tryptophan hydrxylase

Found: 205 nonactive as graph: single | with analogs [1] << Back 161 162 163 164 165 166 167 168 169 170  Next >> [205]
Species: 4932
Condition: ROT2
Replicates: 2
Raw OD Value: r im 0.7903±0.0013435
Normalized OD Score: sc h 0.9603±0.00189997
Z-Score: -1.8754±0.11589
p-Value: 0.0616088
Z-Factor: -1.33358
Fitness Defect: 2.787
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:20|A7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.40 Celcius
Date:2006-05-05 YYYY-MM-DD
Plate CH Control (+):0.039400000000000004±0.00240
Plate DMSO Control (-):0.8128±0.01878
Plate Z-Factor:0.9194
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DBLink | Rows returned: 10<< Back 1 2
4573550 [1-carboxy-2-(4-chlorophenyl)ethyl]azanium
6918890 (2R)-2-azaniumyl-3-(4-chlorophenyl)propanoate
6931462 (2S)-2-azaniumyl-3-(4-chlorophenyl)propanoate
15983252 (2R)-2-amino-3-(4-chlorophenyl)-2-methyl-propanoic acid

internal high similarity DBLink | Rows returned: 1
LOPAC 00493 1.0000

active | Cluster 1385 | Additional Members: 11 | Rows returned: 0
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