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Compound InformationSONAR Target prediction
Name:

Cantharidin

Unique Identifier:LAT003A02
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H12O4
Molecular Weight:184.105 g/mol
X log p:-1.539  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:CC12C3CCC(O3)C1(C)C(=O)OC2=O

Found: 5 nonactive as graph: single | with analogs 2 3 4 5 Next >> 
Species: 4932
Condition: pdr18h
Replicates: 2
Raw OD Value: r im 0.6437±0.0209304
Normalized OD Score: sc h 1.0244±0.018556
Z-Score: 0.8496±0.583227
p-Value: 0.434478
Z-Factor: -3.67717
Fitness Defect: 0.8336
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:3|A2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.039675±0.00190
Plate DMSO Control (-):0.63455±0.01440
Plate Z-Factor:0.9167
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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 4981 | Additional Members: 6 | Rows returned: 2
LOPAC 00793 0
SPE01500814 0

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