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Compound InformationSONAR Target prediction
Name:

Norcantharidin

Unique Identifier:LAT004A04
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8H8O4
Molecular Weight:160.083 g/mol
X log p:-0.299  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:O=C1OC(=O)C2C3CCC(O3)C21

Found: 5 nonactive as graph: single | with analogs 2 3 4 5 Next >> 
Species: 4932
Condition: pdr18h
Replicates: 2
Raw OD Value: r im 0.6710±0.00106066
Normalized OD Score: sc h 1.0660±0.0186882
Z-Score: 1.9867±0.38119
p-Value: 0.0550012
Z-Factor: -4.7945
Fitness Defect: 2.9004
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:4|A4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040825±0.00277
Plate DMSO Control (-):0.640525±0.21231
Plate Z-Factor:-0.0729
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DBLink | Rows returned: 282 3 4 5 Next >> 
2545
5944
93004
198705
198727
238942

internal high similarity DBLink | Rows returned: 6
BIOMOL 62 1.0000
LOPAC 00793 1.0000
LOPAC 01099 1.0000
Prest1130 1.0000
SPE01500814 1.0000
SPE01504153 1.0000

active | Cluster 564 | Additional Members: 4 | Rows returned: 1
SPE01504153 0

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