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Compound InformationSONAR Target prediction
Name:

VALACYCLOVIR HYDROCHLORIDE

Unique Identifier:SPE01505368
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13ClH21N6O4
Molecular Weight:339.63 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Cl.CC(C)C(N)C(=O)OCCOCn1cnc2C(=O)NC(N)=Nc12
Source:synthetic; 256-U-87
Therapeutics:antiviral

Found: 104 nonactive as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [104]
Species: 4932
Condition: TRK1
Replicates: 2
Raw OD Value: r im 0.4713±0.0103238
Normalized OD Score: sc h 0.9818±0.00540757
Z-Score: -0.5671±0.167367
p-Value: 0.57331
Z-Factor: -3.99643
Fitness Defect: 0.5563
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:8|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2008-03-14 YYYY-MM-DD
Plate CH Control (+):0.04025±0.00315
Plate DMSO Control (-):0.4518±0.01746
Plate Z-Factor:0.8630
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 590 | Additional Members: 7 | Rows returned: 1
SPE01503603 0

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