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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 21 22 23 24 25 26 27 28 29 30  Next >> [104]
Species: 4932
Condition: DOC1
Replicates: 2
Raw OD Value: r im 0.5147±0.00565685
Normalized OD Score: sc h 0.9926±0.00854563
Z-Score: -0.2518±0.28619
p-Value: 0.80512
Z-Factor: -20.8884
Fitness Defect: 0.2168
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:8|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2008-05-09 YYYY-MM-DD
Plate CH Control (+):0.041075±0.00065
Plate DMSO Control (-):0.5197±0.02609
Plate Z-Factor:0.8324
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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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