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Compound InformationSONAR Target prediction
Name:

Ganciclovir

Unique Identifier:LOPAC 00932
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9H13N5O4
Molecular Weight:242.128 g/mol
X log p:0.273  (online calculus)
Lipinksi Failures0
TPSA54.26
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:9
Rotatable Bond Count:5
Canonical Smiles:NC1NC(=O)c2ncn(COC(CO)CO)c2N=1
Class:Cell Cycle
Action:Inhibitor
Selectivity:G2-M checkpoint
Generic_name:9-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINE
Chemical_iupac_name:9-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINE
Drug_type:Experimental
Drugbank_id:EXPT01540
Drug_category:Thymidine Kinase inhibitor
Organisms_affected:-1

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: SQS1
Replicates: 2
Raw OD Value: r im 0.7391±0.028355
Normalized OD Score: sc h 0.9974±0.028435
Z-Score: 0.0328±1.39635
p-Value: 0.32372
Z-Factor: -10.8684
Fitness Defect: 1.1279
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:7|F10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-05-21 YYYY-MM-DD
Plate CH Control (+):0.049350000000000005±0.00134
Plate DMSO Control (-):0.7559499999999999±0.03392
Plate Z-Factor:0.8767
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 3
HTS 11460 0.9278
LOPAC 00490 0.9833
SPE01503603 0.9833

active | Cluster 8564 | Additional Members: 2 | Rows returned: 0

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