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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 2 3 4 5 6 7 8 9 10  Next >> [104]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.7211±0.00502046
Normalized OD Score: sc h 1.0124±0.000520414
Z-Score: 0.6577±0.0134438
p-Value: 0.510778
Z-Factor: -1.99081
Fitness Defect: 0.6718
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:8|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.040275±0.00088
Plate DMSO Control (-):0.716475±0.01206
Plate Z-Factor:0.9368
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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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