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Compound InformationSONAR Target prediction
Name:

LAMOTRIGINE

Unique Identifier:SPE01505610
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9Cl2H7N5
Molecular Weight:249.035 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Nc1nnc(c(N)n1)c1cccc(Cl)c1Cl
Source:synthetic; BW-430C
Therapeutics:anticonvulsant

Found: 104 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [104]
Species: 4932
Condition: TOR1
Replicates: 2
Raw OD Value: r im 0.9410±0.0187383
Normalized OD Score: sc h 0.9488±0.0113962
Z-Score: -0.2419±0.405496
p-Value: 0.780652
Z-Factor: -0.812383
Fitness Defect: 0.2476
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:10|E9
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0013750000000000001±0.00233
Plate DMSO Control (-):1.0037±0.01740
Plate Z-Factor:0.9488
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2363 | Additional Members: 2 | Rows returned: 0
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