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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 1 2 3 4 5 6 7 8 9 10  Next >> [104]
Species: 4932
Condition: BEM2
Replicates: 2
Raw OD Value: r im 0.4945±0.0053033
Normalized OD Score: sc h 1.1096±0.0151698
Z-Score: 3.2200±0.395334
p-Value: 0.0018714
Z-Factor: -0.456607
Fitness Defect: 6.2811
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:8|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.20 Celcius
Date:2008-02-05 YYYY-MM-DD
Plate CH Control (+):0.041874999999999996±0.00094
Plate DMSO Control (-):0.44520000000000004±0.01696
Plate Z-Factor:0.8477
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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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